USER MOD reduce.3.24.130724 H: found=0, std=0, add=1002, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1000 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 870 GLN :FLIP amide:sc= 0 F(o=0.52,f=1.3) USER MOD Set 1.2: B 874 THR OG1 : rot 88:sc= 1.28 USER MOD Set 2.1: B 852 CYS SG : rot -8:sc= -4.47! USER MOD Set 2.2: B 856 MET CE :methyl 136:sc= -0.228 (180deg=-0.336) USER MOD Set 3.1: B 848 ASN : amide:sc= -0.0406 K(o=-0.23,f=-1.8) USER MOD Set 3.2: B 851 ASN : amide:sc= -0.15 K(o=-0.23,f=-1.7!) USER MOD Set 3.3: B 882 ASN : amide:sc= -0.0386 K(o=-0.23,f=-1.1) USER MOD Set 4.1: B 833 TYR OH : rot -111:sc= 0.455 USER MOD Set 4.2: B 857 HIS :FLIP no HE2:sc= 1.17 F(o=-3.3!,f=1.6) USER MOD Single : A 233 SER OG : rot 180:sc= 0 USER MOD Single : A 236 THR OG1 : rot 79:sc= 1.22 USER MOD Single : A 238 CYS SG : rot 71:sc= 0.898 USER MOD Single : A 240 THR OG1 : rot 180:sc= -2.61! USER MOD Single : A 241 THR OG1 : rot -79:sc= 1.13 USER MOD Single : A 243 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 244 SER OG : rot -77:sc= 0.342 USER MOD Single : A 246 ASN :FLIP amide:sc= -0.0278 F(o=-1,f=-0.028) USER MOD Single : A 247 LYS NZ :NH3+ -134:sc= -0.125 (180deg=-0.659) USER MOD Single : A 248 THR OG1 : rot 180:sc= 0.189 USER MOD Single : A 250 SER OG : rot -40:sc= -0.825 USER MOD Single : A 251 GLN :FLIP amide:sc= 0 F(o=-0.78,f=0) USER MOD Single : A 252 THR OG1 : rot 67:sc= 1.29 USER MOD Single : A 255 THR OG1 : rot 180:sc= 0 USER MOD Single : A 256 THR OG1 : rot 87:sc= 1.29 USER MOD Single : A 259 SER OG : rot 63:sc= 1.26 USER MOD Single : A 262 GLN :FLIP amide:sc= -1.53 F(o=-2.5,f=-1.5) USER MOD Single : A 267 SER OG : rot 180:sc= 0.0257 USER MOD Single : A 274 CYS SG : rot 51:sc= -2.04! USER MOD Single : A 280 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 281 LYS NZ :NH3+ -149:sc= 0.0235 (180deg=0) USER MOD Single : A 290 HIS :FLIP no HE2:sc= 0.0519 F(o=-1.6,f=0.052) USER MOD Single : A 295 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 834 ASN : amide:sc= 0.196 K(o=0.2,f=-2.3) USER MOD Single : B 838 GLN :FLIP amide:sc= -1.37! C(o=-1.9!,f=-1.4!) USER MOD Single : B 843 LYS NZ :NH3+ -137:sc= 1.7 (180deg=-1.59) USER MOD Single : B 844 MET CE :methyl -117:sc=-0.00303 (180deg=-1.08) USER MOD Single : B 850 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 854 SER OG : rot 83:sc= 1.23 USER MOD Single : B 858 HIS : no HD1:sc= 0 X(o=0,f=-0.0037) USER MOD Single : B 860 LYS NZ :NH3+ -121:sc= 0.785 (180deg=0) USER MOD Single : B 861 ASN :FLIP amide:sc= -2.03 F(o=-3.5!,f=-2) USER MOD Single : B 869 SER OG : rot 180:sc= 0 USER MOD Single : B 875 SER OG : rot 180:sc= 0 USER MOD Single : B 879 ASN : amide:sc= 0.468 K(o=0.47,f=-6.4!) USER MOD Single : B 884 LYS NZ :NH3+ 171:sc= -0.0115 (180deg=-0.171) USER MOD Single : B 885 GLN :FLIP amide:sc= -0.012 F(o=-1.5,f=-0.012) USER MOD Single : B 887 TYR OH : rot 180:sc= 0 USER MOD Single : B 891 HIS : no HE2:sc= 0.476 K(o=0.48,f=-5.5!) USER MOD Single : B 892 THR OG1 : rot 180:sc= 0 USER MOD Single : B 893 SER OG : rot 180:sc= -0.0553 USER MOD ----------------------------------------------------------------- ATOM 197 N PHE A 231 -8.067 8.538 -5.137 1.00 0.00 N ATOM 198 CA PHE A 231 -7.907 7.668 -3.978 1.00 0.00 C ATOM 199 C PHE A 231 -8.559 6.290 -4.205 1.00 0.00 C ATOM 200 O PHE A 231 -7.888 5.258 -4.059 1.00 0.00 O ATOM 201 CB PHE A 231 -8.503 8.367 -2.744 1.00 0.00 C ATOM 202 CG PHE A 231 -8.470 7.596 -1.445 1.00 0.00 C ATOM 203 CD1 PHE A 231 -7.537 6.604 -1.212 1.00 0.00 C ATOM 204 CD2 PHE A 231 -9.377 7.890 -0.455 1.00 0.00 C ATOM 205 CE1 PHE A 231 -7.509 5.920 -0.021 1.00 0.00 C ATOM 206 CE2 PHE A 231 -9.358 7.211 0.737 1.00 0.00 C ATOM 207 CZ PHE A 231 -8.423 6.224 0.956 1.00 0.00 C ATOM 0 HA PHE A 231 -6.844 7.487 -3.816 1.00 0.00 H new ATOM 0 HB2 PHE A 231 -7.971 9.307 -2.595 1.00 0.00 H new ATOM 0 HB3 PHE A 231 -9.540 8.619 -2.964 1.00 0.00 H new ATOM 0 HD1 PHE A 231 -6.817 6.362 -1.980 1.00 0.00 H new ATOM 0 HD2 PHE A 231 -10.113 8.664 -0.617 1.00 0.00 H new ATOM 0 HE1 PHE A 231 -6.772 5.148 0.145 1.00 0.00 H new ATOM 0 HE2 PHE A 231 -10.078 7.451 1.505 1.00 0.00 H new ATOM 0 HZ PHE A 231 -8.409 5.690 1.895 1.00 0.00 H new ATOM 217 N VAL A 232 -9.828 6.268 -4.605 1.00 0.00 N ATOM 218 CA VAL A 232 -10.513 4.992 -4.859 1.00 0.00 C ATOM 219 C VAL A 232 -9.861 4.266 -6.040 1.00 0.00 C ATOM 220 O VAL A 232 -9.812 3.042 -6.075 1.00 0.00 O ATOM 221 CB VAL A 232 -12.040 5.162 -5.125 1.00 0.00 C ATOM 222 CG1 VAL A 232 -12.737 5.743 -3.921 1.00 0.00 C ATOM 223 CG2 VAL A 232 -12.317 6.008 -6.354 1.00 0.00 C ATOM 0 H VAL A 232 -10.399 7.099 -4.760 1.00 0.00 H new ATOM 0 HA VAL A 232 -10.409 4.398 -3.951 1.00 0.00 H new ATOM 0 HB VAL A 232 -12.440 4.166 -5.315 1.00 0.00 H new ATOM 0 HG11 VAL A 232 -13.801 5.851 -4.133 1.00 0.00 H new ATOM 0 HG12 VAL A 232 -12.603 5.079 -3.067 1.00 0.00 H new ATOM 0 HG13 VAL A 232 -12.312 6.720 -3.691 1.00 0.00 H new ATOM 0 HG21 VAL A 232 -13.394 6.098 -6.499 1.00 0.00 H new ATOM 0 HG22 VAL A 232 -11.885 6.999 -6.218 1.00 0.00 H new ATOM 0 HG23 VAL A 232 -11.872 5.535 -7.229 1.00 0.00 H new ATOM 233 N SER A 233 -9.343 5.027 -6.973 1.00 0.00 N ATOM 234 CA SER A 233 -8.648 4.506 -8.104 1.00 0.00 C ATOM 235 C SER A 233 -7.360 3.804 -7.660 1.00 0.00 C ATOM 236 O SER A 233 -7.088 2.659 -8.042 1.00 0.00 O ATOM 237 CB SER A 233 -8.339 5.672 -9.010 1.00 0.00 C ATOM 238 OG SER A 233 -9.515 6.205 -9.588 1.00 0.00 O ATOM 0 H SER A 233 -9.399 6.045 -6.959 1.00 0.00 H new ATOM 0 HA SER A 233 -9.254 3.767 -8.628 1.00 0.00 H new ATOM 0 HB2 SER A 233 -7.827 6.449 -8.443 1.00 0.00 H new ATOM 0 HB3 SER A 233 -7.658 5.351 -9.798 1.00 0.00 H new ATOM 0 HG SER A 233 -9.281 6.960 -10.168 1.00 0.00 H new ATOM 244 N ARG A 234 -6.623 4.476 -6.803 1.00 0.00 N ATOM 245 CA ARG A 234 -5.364 3.993 -6.303 1.00 0.00 C ATOM 246 C ARG A 234 -5.541 2.759 -5.483 1.00 0.00 C ATOM 247 O ARG A 234 -4.815 1.800 -5.665 1.00 0.00 O ATOM 248 CB ARG A 234 -4.656 5.050 -5.486 1.00 0.00 C ATOM 249 CG ARG A 234 -4.324 6.302 -6.243 1.00 0.00 C ATOM 250 CD ARG A 234 -3.545 5.991 -7.505 1.00 0.00 C ATOM 251 NE ARG A 234 -3.171 7.193 -8.227 1.00 0.00 N ATOM 252 CZ ARG A 234 -2.389 7.207 -9.307 1.00 0.00 C ATOM 253 NH1 ARG A 234 -2.047 6.054 -9.910 1.00 0.00 N ATOM 254 NH2 ARG A 234 -2.000 8.369 -9.825 1.00 0.00 N ATOM 0 H ARG A 234 -6.890 5.387 -6.431 1.00 0.00 H new ATOM 0 HA ARG A 234 -4.750 3.750 -7.170 1.00 0.00 H new ATOM 0 HB2 ARG A 234 -5.282 5.311 -4.633 1.00 0.00 H new ATOM 0 HB3 ARG A 234 -3.734 4.626 -5.087 1.00 0.00 H new ATOM 0 HG2 ARG A 234 -5.243 6.828 -6.501 1.00 0.00 H new ATOM 0 HG3 ARG A 234 -3.741 6.970 -5.608 1.00 0.00 H new ATOM 0 HD2 ARG A 234 -2.647 5.430 -7.247 1.00 0.00 H new ATOM 0 HD3 ARG A 234 -4.145 5.352 -8.153 1.00 0.00 H new ATOM 0 HE ARG A 234 -3.530 8.085 -7.886 1.00 0.00 H new ATOM 0 HH11 ARG A 234 -2.386 5.165 -9.541 1.00 0.00 H new ATOM 0 HH12 ARG A 234 -1.449 6.068 -10.736 1.00 0.00 H new ATOM 0 HH21 ARG A 234 -2.300 9.244 -9.396 1.00 0.00 H new ATOM 0 HH22 ARG A 234 -1.402 8.384 -10.651 1.00 0.00 H new ATOM 268 N VAL A 235 -6.508 2.761 -4.585 1.00 0.00 N ATOM 269 CA VAL A 235 -6.745 1.579 -3.780 1.00 0.00 C ATOM 270 C VAL A 235 -7.148 0.395 -4.630 1.00 0.00 C ATOM 271 O VAL A 235 -6.757 -0.718 -4.350 1.00 0.00 O ATOM 272 CB VAL A 235 -7.720 1.777 -2.608 1.00 0.00 C ATOM 273 CG1 VAL A 235 -7.102 2.663 -1.548 1.00 0.00 C ATOM 274 CG2 VAL A 235 -9.023 2.365 -3.077 1.00 0.00 C ATOM 0 H VAL A 235 -7.129 3.548 -4.397 1.00 0.00 H new ATOM 0 HA VAL A 235 -5.781 1.368 -3.316 1.00 0.00 H new ATOM 0 HB VAL A 235 -7.924 0.797 -2.176 1.00 0.00 H new ATOM 0 HG11 VAL A 235 -7.806 2.792 -0.726 1.00 0.00 H new ATOM 0 HG12 VAL A 235 -6.189 2.200 -1.174 1.00 0.00 H new ATOM 0 HG13 VAL A 235 -6.865 3.636 -1.979 1.00 0.00 H new ATOM 0 HG21 VAL A 235 -9.692 2.493 -2.226 1.00 0.00 H new ATOM 0 HG22 VAL A 235 -8.839 3.333 -3.543 1.00 0.00 H new ATOM 0 HG23 VAL A 235 -9.484 1.695 -3.803 1.00 0.00 H new ATOM 284 N THR A 236 -7.872 0.661 -5.697 1.00 0.00 N ATOM 285 CA THR A 236 -8.256 -0.368 -6.640 1.00 0.00 C ATOM 286 C THR A 236 -7.012 -1.065 -7.219 1.00 0.00 C ATOM 287 O THR A 236 -6.858 -2.282 -7.077 1.00 0.00 O ATOM 288 CB THR A 236 -9.125 0.226 -7.773 1.00 0.00 C ATOM 289 OG1 THR A 236 -10.351 0.737 -7.217 1.00 0.00 O ATOM 290 CG2 THR A 236 -9.433 -0.806 -8.847 1.00 0.00 C ATOM 0 H THR A 236 -8.210 1.594 -5.934 1.00 0.00 H new ATOM 0 HA THR A 236 -8.849 -1.113 -6.109 1.00 0.00 H new ATOM 0 HB THR A 236 -8.564 1.033 -8.244 1.00 0.00 H new ATOM 0 HG1 THR A 236 -10.185 1.613 -6.810 1.00 0.00 H new ATOM 0 HG21 THR A 236 -10.045 -0.350 -9.625 1.00 0.00 H new ATOM 0 HG22 THR A 236 -8.501 -1.166 -9.283 1.00 0.00 H new ATOM 0 HG23 THR A 236 -9.973 -1.642 -8.404 1.00 0.00 H new ATOM 298 N GLU A 237 -6.089 -0.272 -7.761 1.00 0.00 N ATOM 299 CA GLU A 237 -4.856 -0.801 -8.337 1.00 0.00 C ATOM 300 C GLU A 237 -3.944 -1.412 -7.265 1.00 0.00 C ATOM 301 O GLU A 237 -3.157 -2.353 -7.529 1.00 0.00 O ATOM 302 CB GLU A 237 -4.126 0.225 -9.212 1.00 0.00 C ATOM 303 CG GLU A 237 -3.847 1.560 -8.548 1.00 0.00 C ATOM 304 CD GLU A 237 -2.957 2.467 -9.371 1.00 0.00 C ATOM 305 OE1 GLU A 237 -1.764 2.181 -9.484 1.00 0.00 O ATOM 306 OE2 GLU A 237 -3.442 3.466 -9.932 1.00 0.00 O ATOM 0 H GLU A 237 -6.173 0.743 -7.813 1.00 0.00 H new ATOM 0 HA GLU A 237 -5.145 -1.612 -9.006 1.00 0.00 H new ATOM 0 HB2 GLU A 237 -3.179 -0.206 -9.536 1.00 0.00 H new ATOM 0 HB3 GLU A 237 -4.719 0.401 -10.109 1.00 0.00 H new ATOM 0 HG2 GLU A 237 -4.793 2.067 -8.357 1.00 0.00 H new ATOM 0 HG3 GLU A 237 -3.378 1.385 -7.580 1.00 0.00 H new ATOM 313 N CYS A 238 -4.031 -0.865 -6.068 1.00 0.00 N ATOM 314 CA CYS A 238 -3.300 -1.364 -4.934 1.00 0.00 C ATOM 315 C CYS A 238 -3.650 -2.802 -4.709 1.00 0.00 C ATOM 316 O CYS A 238 -2.788 -3.651 -4.594 1.00 0.00 O ATOM 317 CB CYS A 238 -3.618 -0.547 -3.689 1.00 0.00 C ATOM 318 SG CYS A 238 -2.858 1.085 -3.638 1.00 0.00 S ATOM 0 H CYS A 238 -4.617 -0.056 -5.860 1.00 0.00 H new ATOM 0 HA CYS A 238 -2.232 -1.277 -5.136 1.00 0.00 H new ATOM 0 HB2 CYS A 238 -4.699 -0.431 -3.615 1.00 0.00 H new ATOM 0 HB3 CYS A 238 -3.297 -1.109 -2.812 1.00 0.00 H new ATOM 0 HG CYS A 238 -3.431 1.858 -4.512 1.00 0.00 H new ATOM 324 N LEU A 239 -4.904 -3.075 -4.712 1.00 0.00 N ATOM 325 CA LEU A 239 -5.373 -4.411 -4.499 1.00 0.00 C ATOM 326 C LEU A 239 -5.032 -5.268 -5.689 1.00 0.00 C ATOM 327 O LEU A 239 -4.585 -6.400 -5.546 1.00 0.00 O ATOM 328 CB LEU A 239 -6.866 -4.367 -4.247 1.00 0.00 C ATOM 329 CG LEU A 239 -7.246 -3.335 -3.204 1.00 0.00 C ATOM 330 CD1 LEU A 239 -8.733 -3.282 -2.935 1.00 0.00 C ATOM 331 CD2 LEU A 239 -6.432 -3.512 -1.943 1.00 0.00 C ATOM 0 H LEU A 239 -5.640 -2.385 -4.861 1.00 0.00 H new ATOM 0 HA LEU A 239 -4.887 -4.853 -3.629 1.00 0.00 H new ATOM 0 HB2 LEU A 239 -7.383 -4.144 -5.180 1.00 0.00 H new ATOM 0 HB3 LEU A 239 -7.206 -5.350 -3.922 1.00 0.00 H new ATOM 0 HG LEU A 239 -6.997 -2.358 -3.619 1.00 0.00 H new ATOM 0 HD11 LEU A 239 -8.939 -2.524 -2.179 1.00 0.00 H new ATOM 0 HD12 LEU A 239 -9.260 -3.030 -3.855 1.00 0.00 H new ATOM 0 HD13 LEU A 239 -9.073 -4.254 -2.576 1.00 0.00 H new ATOM 0 HD21 LEU A 239 -6.725 -2.759 -1.212 1.00 0.00 H new ATOM 0 HD22 LEU A 239 -6.610 -4.506 -1.532 1.00 0.00 H new ATOM 0 HD23 LEU A 239 -5.373 -3.400 -2.175 1.00 0.00 H new ATOM 343 N THR A 240 -5.135 -4.687 -6.869 1.00 0.00 N ATOM 344 CA THR A 240 -4.894 -5.429 -8.073 1.00 0.00 C ATOM 345 C THR A 240 -3.401 -5.526 -8.398 1.00 0.00 C ATOM 346 O THR A 240 -3.037 -5.887 -9.516 1.00 0.00 O ATOM 347 CB THR A 240 -5.662 -4.852 -9.287 1.00 0.00 C ATOM 348 OG1 THR A 240 -5.201 -3.528 -9.598 1.00 0.00 O ATOM 349 CG2 THR A 240 -7.127 -4.772 -8.977 1.00 0.00 C ATOM 0 H THR A 240 -5.383 -3.708 -7.011 1.00 0.00 H new ATOM 0 HA THR A 240 -5.272 -6.433 -7.882 1.00 0.00 H new ATOM 0 HB THR A 240 -5.487 -5.513 -10.136 1.00 0.00 H new ATOM 0 HG1 THR A 240 -5.697 -3.181 -10.369 1.00 0.00 H new ATOM 0 HG21 THR A 240 -7.659 -4.365 -9.837 1.00 0.00 H new ATOM 0 HG22 THR A 240 -7.507 -5.769 -8.754 1.00 0.00 H new ATOM 0 HG23 THR A 240 -7.282 -4.124 -8.114 1.00 0.00 H new ATOM 357 N THR A 241 -2.538 -5.136 -7.442 1.00 0.00 N ATOM 358 CA THR A 241 -1.085 -5.340 -7.591 1.00 0.00 C ATOM 359 C THR A 241 -0.753 -6.793 -7.970 1.00 0.00 C ATOM 360 O THR A 241 0.227 -7.051 -8.686 1.00 0.00 O ATOM 361 CB THR A 241 -0.295 -4.950 -6.318 1.00 0.00 C ATOM 362 OG1 THR A 241 -0.925 -5.505 -5.155 1.00 0.00 O ATOM 363 CG2 THR A 241 -0.170 -3.443 -6.180 1.00 0.00 C ATOM 0 H THR A 241 -2.816 -4.684 -6.571 1.00 0.00 H new ATOM 0 HA THR A 241 -0.776 -4.678 -8.399 1.00 0.00 H new ATOM 0 HB THR A 241 0.711 -5.360 -6.410 1.00 0.00 H new ATOM 0 HG1 THR A 241 -1.697 -4.955 -4.907 1.00 0.00 H new ATOM 0 HG21 THR A 241 0.390 -3.206 -5.276 1.00 0.00 H new ATOM 0 HG22 THR A 241 0.353 -3.040 -7.047 1.00 0.00 H new ATOM 0 HG23 THR A 241 -1.164 -3.000 -6.118 1.00 0.00 H new ATOM 371 N VAL A 242 -1.578 -7.731 -7.510 1.00 0.00 N ATOM 372 CA VAL A 242 -1.395 -9.122 -7.860 1.00 0.00 C ATOM 373 C VAL A 242 -2.236 -9.469 -9.090 1.00 0.00 C ATOM 374 O VAL A 242 -3.154 -8.742 -9.446 1.00 0.00 O ATOM 375 CB VAL A 242 -1.756 -10.065 -6.695 1.00 0.00 C ATOM 376 CG1 VAL A 242 -0.855 -9.840 -5.539 1.00 0.00 C ATOM 377 CG2 VAL A 242 -3.161 -9.858 -6.260 1.00 0.00 C ATOM 0 H VAL A 242 -2.373 -7.547 -6.898 1.00 0.00 H new ATOM 0 HA VAL A 242 -0.338 -9.265 -8.085 1.00 0.00 H new ATOM 0 HB VAL A 242 -1.638 -11.087 -7.054 1.00 0.00 H new ATOM 0 HG11 VAL A 242 -1.128 -10.516 -4.728 1.00 0.00 H new ATOM 0 HG12 VAL A 242 0.176 -10.030 -5.839 1.00 0.00 H new ATOM 0 HG13 VAL A 242 -0.950 -8.809 -5.199 1.00 0.00 H new ATOM 0 HG21 VAL A 242 -3.391 -10.535 -5.437 1.00 0.00 H new ATOM 0 HG22 VAL A 242 -3.291 -8.828 -5.929 1.00 0.00 H new ATOM 0 HG23 VAL A 242 -3.833 -10.059 -7.094 1.00 0.00 H new ATOM 387 N LYS A 243 -1.937 -10.578 -9.712 1.00 0.00 N ATOM 388 CA LYS A 243 -2.614 -11.005 -10.929 1.00 0.00 C ATOM 389 C LYS A 243 -4.050 -11.453 -10.664 1.00 0.00 C ATOM 390 O LYS A 243 -4.979 -11.101 -11.401 1.00 0.00 O ATOM 391 CB LYS A 243 -1.837 -12.159 -11.562 1.00 0.00 C ATOM 392 CG LYS A 243 -2.498 -12.834 -12.774 1.00 0.00 C ATOM 393 CD LYS A 243 -2.386 -12.059 -14.112 1.00 0.00 C ATOM 394 CE LYS A 243 -3.141 -10.734 -14.120 1.00 0.00 C ATOM 395 NZ LYS A 243 -3.262 -10.164 -15.472 1.00 0.00 N ATOM 0 H LYS A 243 -1.213 -11.222 -9.394 1.00 0.00 H new ATOM 0 HA LYS A 243 -2.651 -10.149 -11.603 1.00 0.00 H new ATOM 0 HB2 LYS A 243 -0.859 -11.787 -11.867 1.00 0.00 H new ATOM 0 HB3 LYS A 243 -1.666 -12.917 -10.798 1.00 0.00 H new ATOM 0 HG2 LYS A 243 -2.052 -13.820 -12.907 1.00 0.00 H new ATOM 0 HG3 LYS A 243 -3.554 -12.989 -12.551 1.00 0.00 H new ATOM 0 HD2 LYS A 243 -1.334 -11.868 -14.324 1.00 0.00 H new ATOM 0 HD3 LYS A 243 -2.765 -12.687 -14.918 1.00 0.00 H new ATOM 0 HE2 LYS A 243 -4.136 -10.884 -13.702 1.00 0.00 H new ATOM 0 HE3 LYS A 243 -2.627 -10.023 -13.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 243 -3.782 -9.265 -15.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 243 -2.314 -9.995 -15.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 243 -3.776 -10.829 -16.085 1.00 0.00 H new ATOM 409 N SER A 244 -4.198 -12.267 -9.667 1.00 0.00 N ATOM 410 CA SER A 244 -5.468 -12.838 -9.306 1.00 0.00 C ATOM 411 C SER A 244 -6.521 -11.781 -8.929 1.00 0.00 C ATOM 412 O SER A 244 -7.657 -11.838 -9.413 1.00 0.00 O ATOM 413 CB SER A 244 -5.232 -13.805 -8.185 1.00 0.00 C ATOM 414 OG SER A 244 -4.189 -14.684 -8.547 1.00 0.00 O ATOM 0 H SER A 244 -3.428 -12.562 -9.066 1.00 0.00 H new ATOM 0 HA SER A 244 -5.884 -13.351 -10.173 1.00 0.00 H new ATOM 0 HB2 SER A 244 -4.972 -13.268 -7.273 1.00 0.00 H new ATOM 0 HB3 SER A 244 -6.142 -14.367 -7.975 1.00 0.00 H new ATOM 0 HG SER A 244 -4.530 -15.356 -9.173 1.00 0.00 H new ATOM 420 N VAL A 245 -6.153 -10.846 -8.071 1.00 0.00 N ATOM 421 CA VAL A 245 -7.084 -9.772 -7.667 1.00 0.00 C ATOM 422 C VAL A 245 -7.397 -8.850 -8.849 1.00 0.00 C ATOM 423 O VAL A 245 -6.499 -8.249 -9.432 1.00 0.00 O ATOM 424 CB VAL A 245 -6.500 -8.923 -6.508 1.00 0.00 C ATOM 425 CG1 VAL A 245 -7.377 -7.731 -6.188 1.00 0.00 C ATOM 426 CG2 VAL A 245 -6.319 -9.761 -5.261 1.00 0.00 C ATOM 0 H VAL A 245 -5.231 -10.796 -7.637 1.00 0.00 H new ATOM 0 HA VAL A 245 -8.000 -10.255 -7.327 1.00 0.00 H new ATOM 0 HB VAL A 245 -5.529 -8.558 -6.843 1.00 0.00 H new ATOM 0 HG11 VAL A 245 -6.934 -7.162 -5.371 1.00 0.00 H new ATOM 0 HG12 VAL A 245 -7.462 -7.095 -7.069 1.00 0.00 H new ATOM 0 HG13 VAL A 245 -8.368 -8.077 -5.893 1.00 0.00 H new ATOM 0 HG21 VAL A 245 -5.908 -9.142 -4.463 1.00 0.00 H new ATOM 0 HG22 VAL A 245 -7.283 -10.162 -4.949 1.00 0.00 H new ATOM 0 HG23 VAL A 245 -5.635 -10.583 -5.471 1.00 0.00 H new ATOM 436 N ASN A 246 -8.648 -8.773 -9.226 1.00 0.00 N ATOM 437 CA ASN A 246 -9.051 -7.863 -10.287 1.00 0.00 C ATOM 438 C ASN A 246 -9.873 -6.747 -9.695 1.00 0.00 C ATOM 439 O ASN A 246 -10.150 -6.773 -8.505 1.00 0.00 O ATOM 440 CB ASN A 246 -9.834 -8.582 -11.394 1.00 0.00 C ATOM 441 CG ASN A 246 -8.994 -9.555 -12.208 1.00 0.00 C ATOM 442 OD1 ASN A 246 -7.746 -9.231 -12.448 1.00 0.00 O flip ATOM 443 ND2 ASN A 246 -9.490 -10.591 -12.647 1.00 0.00 N flip ATOM 0 H ASN A 246 -9.406 -9.322 -8.822 1.00 0.00 H new ATOM 0 HA ASN A 246 -8.152 -7.455 -10.750 1.00 0.00 H new ATOM 0 HB2 ASN A 246 -10.666 -9.123 -10.944 1.00 0.00 H new ATOM 0 HB3 ASN A 246 -10.263 -7.838 -12.065 1.00 0.00 H new ATOM 0 HD21 ASN A 246 -10.464 -10.816 -12.444 1.00 0.00 H new ATOM 0 HD22 ASN A 246 -8.928 -11.225 -13.215 1.00 0.00 H new ATOM 450 N LYS A 247 -10.288 -5.776 -10.526 1.00 0.00 N ATOM 451 CA LYS A 247 -11.089 -4.610 -10.074 1.00 0.00 C ATOM 452 C LYS A 247 -12.363 -5.069 -9.346 1.00 0.00 C ATOM 453 O LYS A 247 -12.936 -4.344 -8.524 1.00 0.00 O ATOM 454 CB LYS A 247 -11.474 -3.664 -11.245 1.00 0.00 C ATOM 455 CG LYS A 247 -12.713 -4.087 -12.064 1.00 0.00 C ATOM 456 CD LYS A 247 -12.495 -5.329 -12.912 1.00 0.00 C ATOM 457 CE LYS A 247 -11.622 -5.031 -14.118 1.00 0.00 C ATOM 458 NZ LYS A 247 -12.200 -3.971 -14.987 1.00 0.00 N ATOM 0 H LYS A 247 -10.083 -5.770 -11.525 1.00 0.00 H new ATOM 0 HA LYS A 247 -10.456 -4.050 -9.385 1.00 0.00 H new ATOM 0 HB2 LYS A 247 -11.651 -2.667 -10.840 1.00 0.00 H new ATOM 0 HB3 LYS A 247 -10.623 -3.587 -11.921 1.00 0.00 H new ATOM 0 HG2 LYS A 247 -13.544 -4.266 -11.382 1.00 0.00 H new ATOM 0 HG3 LYS A 247 -13.006 -3.262 -12.714 1.00 0.00 H new ATOM 0 HD2 LYS A 247 -12.029 -6.107 -12.307 1.00 0.00 H new ATOM 0 HD3 LYS A 247 -13.457 -5.718 -13.245 1.00 0.00 H new ATOM 0 HE2 LYS A 247 -10.633 -4.721 -13.780 1.00 0.00 H new ATOM 0 HE3 LYS A 247 -11.488 -5.942 -14.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 247 -12.147 -4.270 -15.982 1.00 0.00 H new ATOM 0 HZ2 LYS A 247 -13.194 -3.812 -14.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 247 -11.664 -3.089 -14.862 1.00 0.00 H new ATOM 472 N THR A 248 -12.811 -6.246 -9.708 1.00 0.00 N ATOM 473 CA THR A 248 -13.946 -6.892 -9.156 1.00 0.00 C ATOM 474 C THR A 248 -13.716 -7.120 -7.651 1.00 0.00 C ATOM 475 O THR A 248 -14.586 -6.847 -6.813 1.00 0.00 O ATOM 476 CB THR A 248 -14.048 -8.228 -9.859 1.00 0.00 C ATOM 477 OG1 THR A 248 -13.434 -8.076 -11.174 1.00 0.00 O ATOM 478 CG2 THR A 248 -15.485 -8.606 -10.044 1.00 0.00 C ATOM 0 H THR A 248 -12.359 -6.798 -10.437 1.00 0.00 H new ATOM 0 HA THR A 248 -14.853 -6.301 -9.283 1.00 0.00 H new ATOM 0 HB THR A 248 -13.552 -9.000 -9.270 1.00 0.00 H new ATOM 0 HG1 THR A 248 -13.482 -8.927 -11.658 1.00 0.00 H new ATOM 0 HG21 THR A 248 -15.546 -9.569 -10.551 1.00 0.00 H new ATOM 0 HG22 THR A 248 -15.971 -8.677 -9.071 1.00 0.00 H new ATOM 0 HG23 THR A 248 -15.986 -7.847 -10.645 1.00 0.00 H new ATOM 486 N ASP A 249 -12.535 -7.590 -7.314 1.00 0.00 N ATOM 487 CA ASP A 249 -12.166 -7.790 -5.962 1.00 0.00 C ATOM 488 C ASP A 249 -11.935 -6.464 -5.273 1.00 0.00 C ATOM 489 O ASP A 249 -12.282 -6.294 -4.114 1.00 0.00 O ATOM 490 CB ASP A 249 -10.928 -8.621 -5.874 1.00 0.00 C ATOM 491 CG ASP A 249 -10.677 -8.973 -4.461 1.00 0.00 C ATOM 492 OD1 ASP A 249 -11.671 -9.374 -3.794 1.00 0.00 O ATOM 493 OD2 ASP A 249 -9.532 -8.933 -4.030 1.00 0.00 O ATOM 0 H ASP A 249 -11.811 -7.841 -7.987 1.00 0.00 H new ATOM 0 HA ASP A 249 -12.982 -8.313 -5.463 1.00 0.00 H new ATOM 0 HB2 ASP A 249 -11.040 -9.525 -6.472 1.00 0.00 H new ATOM 0 HB3 ASP A 249 -10.078 -8.073 -6.281 1.00 0.00 H new ATOM 498 N SER A 250 -11.393 -5.509 -6.013 1.00 0.00 N ATOM 499 CA SER A 250 -11.142 -4.191 -5.496 1.00 0.00 C ATOM 500 C SER A 250 -12.416 -3.600 -4.915 1.00 0.00 C ATOM 501 O SER A 250 -12.459 -3.249 -3.750 1.00 0.00 O ATOM 502 CB SER A 250 -10.620 -3.312 -6.595 1.00 0.00 C ATOM 503 OG SER A 250 -9.576 -3.959 -7.277 1.00 0.00 O ATOM 0 H SER A 250 -11.118 -5.635 -6.987 1.00 0.00 H new ATOM 0 HA SER A 250 -10.398 -4.256 -4.702 1.00 0.00 H new ATOM 0 HB2 SER A 250 -11.424 -3.070 -7.290 1.00 0.00 H new ATOM 0 HB3 SER A 250 -10.264 -2.370 -6.179 1.00 0.00 H new ATOM 0 HG SER A 250 -9.008 -4.432 -6.633 1.00 0.00 H new ATOM 509 N GLN A 251 -13.479 -3.581 -5.713 1.00 0.00 N ATOM 510 CA GLN A 251 -14.762 -3.056 -5.261 1.00 0.00 C ATOM 511 C GLN A 251 -15.335 -3.899 -4.115 1.00 0.00 C ATOM 512 O GLN A 251 -16.017 -3.379 -3.224 1.00 0.00 O ATOM 513 CB GLN A 251 -15.752 -2.920 -6.418 1.00 0.00 C ATOM 514 CG GLN A 251 -15.991 -4.193 -7.211 1.00 0.00 C ATOM 515 CD GLN A 251 -17.009 -4.021 -8.321 1.00 0.00 C ATOM 516 OE1 GLN A 251 -17.082 -2.837 -8.897 1.00 0.00 O flip ATOM 517 NE2 GLN A 251 -17.723 -4.963 -8.672 1.00 0.00 N flip ATOM 0 H GLN A 251 -13.477 -3.923 -6.674 1.00 0.00 H new ATOM 0 HA GLN A 251 -14.589 -2.053 -4.870 1.00 0.00 H new ATOM 0 HB2 GLN A 251 -16.706 -2.572 -6.021 1.00 0.00 H new ATOM 0 HB3 GLN A 251 -15.390 -2.149 -7.098 1.00 0.00 H new ATOM 0 HG2 GLN A 251 -15.047 -4.529 -7.641 1.00 0.00 H new ATOM 0 HG3 GLN A 251 -16.330 -4.977 -6.534 1.00 0.00 H new ATOM 0 HE21 GLN A 251 -17.641 -5.866 -8.205 1.00 0.00 H new ATOM 0 HE22 GLN A 251 -18.395 -4.839 -9.429 1.00 0.00 H new ATOM 526 N THR A 252 -15.023 -5.181 -4.131 1.00 0.00 N ATOM 527 CA THR A 252 -15.398 -6.085 -3.071 1.00 0.00 C ATOM 528 C THR A 252 -14.762 -5.641 -1.734 1.00 0.00 C ATOM 529 O THR A 252 -15.448 -5.486 -0.714 1.00 0.00 O ATOM 530 CB THR A 252 -14.942 -7.525 -3.414 1.00 0.00 C ATOM 531 OG1 THR A 252 -15.632 -7.984 -4.593 1.00 0.00 O ATOM 532 CG2 THR A 252 -15.181 -8.481 -2.255 1.00 0.00 C ATOM 0 H THR A 252 -14.499 -5.623 -4.886 1.00 0.00 H new ATOM 0 HA THR A 252 -16.483 -6.067 -2.969 1.00 0.00 H new ATOM 0 HB THR A 252 -13.869 -7.505 -3.605 1.00 0.00 H new ATOM 0 HG1 THR A 252 -15.342 -7.458 -5.367 1.00 0.00 H new ATOM 0 HG21 THR A 252 -14.849 -9.481 -2.534 1.00 0.00 H new ATOM 0 HG22 THR A 252 -14.622 -8.143 -1.383 1.00 0.00 H new ATOM 0 HG23 THR A 252 -16.244 -8.505 -2.017 1.00 0.00 H new ATOM 540 N LEU A 253 -13.482 -5.400 -1.751 1.00 0.00 N ATOM 541 CA LEU A 253 -12.764 -5.031 -0.553 1.00 0.00 C ATOM 542 C LEU A 253 -13.058 -3.605 -0.168 1.00 0.00 C ATOM 543 O LEU A 253 -13.032 -3.259 1.017 1.00 0.00 O ATOM 544 CB LEU A 253 -11.273 -5.246 -0.728 1.00 0.00 C ATOM 545 CG LEU A 253 -10.872 -6.619 -1.288 1.00 0.00 C ATOM 546 CD1 LEU A 253 -9.370 -6.775 -1.369 1.00 0.00 C ATOM 547 CD2 LEU A 253 -11.485 -7.741 -0.484 1.00 0.00 C ATOM 0 H LEU A 253 -12.904 -5.452 -2.590 1.00 0.00 H new ATOM 0 HA LEU A 253 -13.106 -5.676 0.256 1.00 0.00 H new ATOM 0 HB2 LEU A 253 -10.886 -4.473 -1.392 1.00 0.00 H new ATOM 0 HB3 LEU A 253 -10.786 -5.109 0.238 1.00 0.00 H new ATOM 0 HG LEU A 253 -11.265 -6.677 -2.303 1.00 0.00 H new ATOM 0 HD11 LEU A 253 -9.128 -7.759 -1.770 1.00 0.00 H new ATOM 0 HD12 LEU A 253 -8.959 -6.006 -2.023 1.00 0.00 H new ATOM 0 HD13 LEU A 253 -8.939 -6.673 -0.373 1.00 0.00 H new ATOM 0 HD21 LEU A 253 -11.182 -8.699 -0.906 1.00 0.00 H new ATOM 0 HD22 LEU A 253 -11.145 -7.676 0.550 1.00 0.00 H new ATOM 0 HD23 LEU A 253 -12.571 -7.659 -0.514 1.00 0.00 H new ATOM 559 N LEU A 254 -13.352 -2.785 -1.155 1.00 0.00 N ATOM 560 CA LEU A 254 -13.699 -1.390 -0.920 1.00 0.00 C ATOM 561 C LEU A 254 -14.900 -1.276 -0.026 1.00 0.00 C ATOM 562 O LEU A 254 -14.903 -0.519 0.921 1.00 0.00 O ATOM 563 CB LEU A 254 -13.995 -0.626 -2.211 1.00 0.00 C ATOM 564 CG LEU A 254 -12.836 -0.283 -3.152 1.00 0.00 C ATOM 565 CD1 LEU A 254 -13.004 1.142 -3.590 1.00 0.00 C ATOM 566 CD2 LEU A 254 -11.468 -0.483 -2.506 1.00 0.00 C ATOM 0 H LEU A 254 -13.359 -3.059 -2.137 1.00 0.00 H new ATOM 0 HA LEU A 254 -12.824 -0.947 -0.445 1.00 0.00 H new ATOM 0 HB2 LEU A 254 -14.719 -1.209 -2.780 1.00 0.00 H new ATOM 0 HB3 LEU A 254 -14.483 0.309 -1.936 1.00 0.00 H new ATOM 0 HG LEU A 254 -12.868 -0.962 -4.004 1.00 0.00 H new ATOM 0 HD11 LEU A 254 -12.191 1.414 -4.263 1.00 0.00 H new ATOM 0 HD12 LEU A 254 -13.956 1.253 -4.108 1.00 0.00 H new ATOM 0 HD13 LEU A 254 -12.987 1.795 -2.718 1.00 0.00 H new ATOM 0 HD21 LEU A 254 -10.687 -0.224 -3.221 1.00 0.00 H new ATOM 0 HD22 LEU A 254 -11.383 0.157 -1.628 1.00 0.00 H new ATOM 0 HD23 LEU A 254 -11.356 -1.525 -2.207 1.00 0.00 H new ATOM 578 N THR A 255 -15.907 -2.027 -0.341 1.00 0.00 N ATOM 579 CA THR A 255 -17.134 -1.998 0.414 1.00 0.00 C ATOM 580 C THR A 255 -16.982 -2.767 1.745 1.00 0.00 C ATOM 581 O THR A 255 -17.696 -2.500 2.715 1.00 0.00 O ATOM 582 CB THR A 255 -18.346 -2.512 -0.429 1.00 0.00 C ATOM 583 OG1 THR A 255 -19.583 -2.264 0.252 1.00 0.00 O ATOM 584 CG2 THR A 255 -18.228 -3.997 -0.735 1.00 0.00 C ATOM 0 H THR A 255 -15.909 -2.679 -1.126 1.00 0.00 H new ATOM 0 HA THR A 255 -17.348 -0.958 0.661 1.00 0.00 H new ATOM 0 HB THR A 255 -18.335 -1.962 -1.370 1.00 0.00 H new ATOM 0 HG1 THR A 255 -20.328 -2.592 -0.293 1.00 0.00 H new ATOM 0 HG21 THR A 255 -19.089 -4.317 -1.322 1.00 0.00 H new ATOM 0 HG22 THR A 255 -17.314 -4.180 -1.300 1.00 0.00 H new ATOM 0 HG23 THR A 255 -18.196 -4.559 0.198 1.00 0.00 H new ATOM 592 N THR A 256 -16.056 -3.717 1.777 1.00 0.00 N ATOM 593 CA THR A 256 -15.819 -4.500 2.965 1.00 0.00 C ATOM 594 C THR A 256 -15.043 -3.707 4.017 1.00 0.00 C ATOM 595 O THR A 256 -15.491 -3.569 5.153 1.00 0.00 O ATOM 596 CB THR A 256 -15.077 -5.807 2.617 1.00 0.00 C ATOM 597 OG1 THR A 256 -15.880 -6.554 1.682 1.00 0.00 O ATOM 598 CG2 THR A 256 -14.822 -6.658 3.862 1.00 0.00 C ATOM 0 H THR A 256 -15.459 -3.958 0.986 1.00 0.00 H new ATOM 0 HA THR A 256 -16.790 -4.752 3.391 1.00 0.00 H new ATOM 0 HB THR A 256 -14.110 -5.554 2.183 1.00 0.00 H new ATOM 0 HG1 THR A 256 -15.682 -6.256 0.770 1.00 0.00 H new ATOM 0 HG21 THR A 256 -14.298 -7.570 3.578 1.00 0.00 H new ATOM 0 HG22 THR A 256 -14.213 -6.095 4.569 1.00 0.00 H new ATOM 0 HG23 THR A 256 -15.773 -6.916 4.327 1.00 0.00 H new ATOM 606 N PHE A 257 -13.904 -3.188 3.639 1.00 0.00 N ATOM 607 CA PHE A 257 -13.080 -2.470 4.570 1.00 0.00 C ATOM 608 C PHE A 257 -13.377 -0.998 4.474 1.00 0.00 C ATOM 609 O PHE A 257 -13.878 -0.387 5.407 1.00 0.00 O ATOM 610 CB PHE A 257 -11.628 -2.751 4.272 1.00 0.00 C ATOM 611 CG PHE A 257 -11.299 -4.213 4.287 1.00 0.00 C ATOM 612 CD1 PHE A 257 -10.977 -4.859 5.468 1.00 0.00 C ATOM 613 CD2 PHE A 257 -11.327 -4.945 3.114 1.00 0.00 C ATOM 614 CE1 PHE A 257 -10.688 -6.206 5.476 1.00 0.00 C ATOM 615 CE2 PHE A 257 -11.037 -6.285 3.118 1.00 0.00 C ATOM 616 CZ PHE A 257 -10.716 -6.920 4.299 1.00 0.00 C ATOM 0 H PHE A 257 -13.528 -3.250 2.693 1.00 0.00 H new ATOM 0 HA PHE A 257 -13.294 -2.797 5.588 1.00 0.00 H new ATOM 0 HB2 PHE A 257 -11.377 -2.338 3.295 1.00 0.00 H new ATOM 0 HB3 PHE A 257 -11.006 -2.237 5.005 1.00 0.00 H new ATOM 0 HD1 PHE A 257 -10.952 -4.301 6.393 1.00 0.00 H new ATOM 0 HD2 PHE A 257 -11.580 -4.456 2.185 1.00 0.00 H new ATOM 0 HE1 PHE A 257 -10.440 -6.701 6.403 1.00 0.00 H new ATOM 0 HE2 PHE A 257 -11.060 -6.844 2.194 1.00 0.00 H new ATOM 0 HZ PHE A 257 -10.487 -7.975 4.301 1.00 0.00 H new ATOM 626 N GLY A 258 -13.091 -0.443 3.328 1.00 0.00 N ATOM 627 CA GLY A 258 -13.391 0.945 3.088 1.00 0.00 C ATOM 628 C GLY A 258 -12.242 1.894 3.296 1.00 0.00 C ATOM 629 O GLY A 258 -12.375 3.082 3.027 1.00 0.00 O ATOM 0 H GLY A 258 -12.651 -0.928 2.546 1.00 0.00 H new ATOM 0 HA2 GLY A 258 -13.748 1.051 2.064 1.00 0.00 H new ATOM 0 HA3 GLY A 258 -14.210 1.242 3.743 1.00 0.00 H new ATOM 633 N SER A 259 -11.109 1.388 3.698 1.00 0.00 N ATOM 634 CA SER A 259 -9.952 2.224 3.950 1.00 0.00 C ATOM 635 C SER A 259 -8.694 1.435 3.642 1.00 0.00 C ATOM 636 O SER A 259 -8.686 0.208 3.810 1.00 0.00 O ATOM 637 CB SER A 259 -9.958 2.717 5.409 1.00 0.00 C ATOM 638 OG SER A 259 -8.803 3.472 5.709 1.00 0.00 O ATOM 0 H SER A 259 -10.955 0.393 3.861 1.00 0.00 H new ATOM 0 HA SER A 259 -9.983 3.102 3.305 1.00 0.00 H new ATOM 0 HB2 SER A 259 -10.846 3.325 5.584 1.00 0.00 H new ATOM 0 HB3 SER A 259 -10.019 1.862 6.082 1.00 0.00 H new ATOM 0 HG SER A 259 -8.789 4.281 5.157 1.00 0.00 H new ATOM 644 N LEU A 260 -7.633 2.126 3.197 1.00 0.00 N ATOM 645 CA LEU A 260 -6.390 1.462 2.816 1.00 0.00 C ATOM 646 C LEU A 260 -5.778 0.819 4.040 1.00 0.00 C ATOM 647 O LEU A 260 -5.278 -0.288 3.960 1.00 0.00 O ATOM 648 CB LEU A 260 -5.403 2.458 2.131 1.00 0.00 C ATOM 649 CG LEU A 260 -4.174 1.870 1.359 1.00 0.00 C ATOM 650 CD1 LEU A 260 -3.071 1.391 2.288 1.00 0.00 C ATOM 651 CD2 LEU A 260 -4.608 0.731 0.448 1.00 0.00 C ATOM 0 H LEU A 260 -7.617 3.141 3.095 1.00 0.00 H new ATOM 0 HA LEU A 260 -6.606 0.686 2.082 1.00 0.00 H new ATOM 0 HB2 LEU A 260 -5.976 3.066 1.431 1.00 0.00 H new ATOM 0 HB3 LEU A 260 -5.022 3.131 2.900 1.00 0.00 H new ATOM 0 HG LEU A 260 -3.767 2.685 0.760 1.00 0.00 H new ATOM 0 HD11 LEU A 260 -2.245 0.994 1.698 1.00 0.00 H new ATOM 0 HD12 LEU A 260 -2.716 2.226 2.893 1.00 0.00 H new ATOM 0 HD13 LEU A 260 -3.459 0.609 2.941 1.00 0.00 H new ATOM 0 HD21 LEU A 260 -3.740 0.336 -0.080 1.00 0.00 H new ATOM 0 HD22 LEU A 260 -5.061 -0.060 1.045 1.00 0.00 H new ATOM 0 HD23 LEU A 260 -5.335 1.100 -0.275 1.00 0.00 H new ATOM 663 N GLU A 261 -5.882 1.512 5.175 1.00 0.00 N ATOM 664 CA GLU A 261 -5.389 1.039 6.475 1.00 0.00 C ATOM 665 C GLU A 261 -5.860 -0.398 6.747 1.00 0.00 C ATOM 666 O GLU A 261 -5.066 -1.278 7.035 1.00 0.00 O ATOM 667 CB GLU A 261 -5.917 1.964 7.579 1.00 0.00 C ATOM 668 CG GLU A 261 -5.439 1.628 8.979 1.00 0.00 C ATOM 669 CD GLU A 261 -6.210 2.386 10.041 1.00 0.00 C ATOM 670 OE1 GLU A 261 -7.292 1.911 10.461 1.00 0.00 O ATOM 671 OE2 GLU A 261 -5.776 3.463 10.474 1.00 0.00 O ATOM 0 H GLU A 261 -6.318 2.433 5.220 1.00 0.00 H new ATOM 0 HA GLU A 261 -4.299 1.050 6.462 1.00 0.00 H new ATOM 0 HB2 GLU A 261 -5.623 2.987 7.347 1.00 0.00 H new ATOM 0 HB3 GLU A 261 -7.007 1.935 7.566 1.00 0.00 H new ATOM 0 HG2 GLU A 261 -5.544 0.557 9.150 1.00 0.00 H new ATOM 0 HG3 GLU A 261 -4.378 1.862 9.065 1.00 0.00 H new ATOM 678 N GLN A 262 -7.147 -0.628 6.586 1.00 0.00 N ATOM 679 CA GLN A 262 -7.738 -1.943 6.849 1.00 0.00 C ATOM 680 C GLN A 262 -7.386 -2.908 5.766 1.00 0.00 C ATOM 681 O GLN A 262 -7.334 -4.098 6.006 1.00 0.00 O ATOM 682 CB GLN A 262 -9.272 -1.912 7.037 1.00 0.00 C ATOM 683 CG GLN A 262 -9.922 -0.555 6.890 1.00 0.00 C ATOM 684 CD GLN A 262 -9.738 0.381 8.101 1.00 0.00 C ATOM 685 OE1 GLN A 262 -8.695 0.203 8.863 1.00 0.00 O flip ATOM 686 NE2 GLN A 262 -10.574 1.235 8.353 1.00 0.00 N flip ATOM 0 H GLN A 262 -7.815 0.077 6.273 1.00 0.00 H new ATOM 0 HA GLN A 262 -7.311 -2.271 7.797 1.00 0.00 H new ATOM 0 HB2 GLN A 262 -9.722 -2.591 6.313 1.00 0.00 H new ATOM 0 HB3 GLN A 262 -9.506 -2.302 8.028 1.00 0.00 H new ATOM 0 HG2 GLN A 262 -9.515 -0.066 6.005 1.00 0.00 H new ATOM 0 HG3 GLN A 262 -10.989 -0.695 6.715 1.00 0.00 H new ATOM 0 HE21 GLN A 262 -11.381 1.355 7.741 1.00 0.00 H new ATOM 0 HE22 GLN A 262 -10.465 1.829 9.175 1.00 0.00 H new ATOM 695 N LEU A 263 -7.142 -2.390 4.578 1.00 0.00 N ATOM 696 CA LEU A 263 -6.832 -3.216 3.446 1.00 0.00 C ATOM 697 C LEU A 263 -5.502 -3.907 3.644 1.00 0.00 C ATOM 698 O LEU A 263 -5.378 -5.098 3.434 1.00 0.00 O ATOM 699 CB LEU A 263 -6.823 -2.395 2.163 1.00 0.00 C ATOM 700 CG LEU A 263 -7.977 -2.633 1.198 1.00 0.00 C ATOM 701 CD1 LEU A 263 -8.064 -4.101 0.847 1.00 0.00 C ATOM 702 CD2 LEU A 263 -9.284 -2.134 1.756 1.00 0.00 C ATOM 0 H LEU A 263 -7.155 -1.390 4.379 1.00 0.00 H new ATOM 0 HA LEU A 263 -7.607 -3.977 3.356 1.00 0.00 H new ATOM 0 HB2 LEU A 263 -6.816 -1.339 2.433 1.00 0.00 H new ATOM 0 HB3 LEU A 263 -5.890 -2.595 1.636 1.00 0.00 H new ATOM 0 HG LEU A 263 -7.780 -2.064 0.289 1.00 0.00 H new ATOM 0 HD11 LEU A 263 -8.892 -4.262 0.157 1.00 0.00 H new ATOM 0 HD12 LEU A 263 -7.133 -4.419 0.377 1.00 0.00 H new ATOM 0 HD13 LEU A 263 -8.230 -4.683 1.754 1.00 0.00 H new ATOM 0 HD21 LEU A 263 -10.082 -2.322 1.038 1.00 0.00 H new ATOM 0 HD22 LEU A 263 -9.504 -2.655 2.688 1.00 0.00 H new ATOM 0 HD23 LEU A 263 -9.213 -1.063 1.947 1.00 0.00 H new ATOM 714 N ILE A 264 -4.528 -3.146 4.075 1.00 0.00 N ATOM 715 CA ILE A 264 -3.222 -3.677 4.363 1.00 0.00 C ATOM 716 C ILE A 264 -3.253 -4.477 5.667 1.00 0.00 C ATOM 717 O ILE A 264 -2.590 -5.502 5.795 1.00 0.00 O ATOM 718 CB ILE A 264 -2.100 -2.539 4.342 1.00 0.00 C ATOM 719 CG1 ILE A 264 -0.773 -2.956 5.017 1.00 0.00 C ATOM 720 CG2 ILE A 264 -2.601 -1.249 4.960 1.00 0.00 C ATOM 721 CD1 ILE A 264 -0.799 -2.833 6.554 1.00 0.00 C ATOM 0 H ILE A 264 -4.619 -2.143 4.236 1.00 0.00 H new ATOM 0 HA ILE A 264 -2.942 -4.370 3.570 1.00 0.00 H new ATOM 0 HB ILE A 264 -1.885 -2.378 3.286 1.00 0.00 H new ATOM 0 HG12 ILE A 264 -0.546 -3.987 4.747 1.00 0.00 H new ATOM 0 HG13 ILE A 264 0.035 -2.338 4.625 1.00 0.00 H new ATOM 0 HG21 ILE A 264 -1.811 -0.499 4.928 1.00 0.00 H new ATOM 0 HG22 ILE A 264 -3.465 -0.890 4.401 1.00 0.00 H new ATOM 0 HG23 ILE A 264 -2.888 -1.429 5.996 1.00 0.00 H new ATOM 0 HD11 ILE A 264 0.164 -3.142 6.960 1.00 0.00 H new ATOM 0 HD12 ILE A 264 -0.995 -1.798 6.833 1.00 0.00 H new ATOM 0 HD13 ILE A 264 -1.584 -3.472 6.957 1.00 0.00 H new ATOM 733 N ALA A 265 -4.034 -3.999 6.635 1.00 0.00 N ATOM 734 CA ALA A 265 -4.142 -4.656 7.933 1.00 0.00 C ATOM 735 C ALA A 265 -4.876 -5.984 7.832 1.00 0.00 C ATOM 736 O ALA A 265 -4.842 -6.799 8.765 1.00 0.00 O ATOM 737 CB ALA A 265 -4.823 -3.750 8.942 1.00 0.00 C ATOM 0 H ALA A 265 -4.602 -3.157 6.542 1.00 0.00 H new ATOM 0 HA ALA A 265 -3.128 -4.862 8.277 1.00 0.00 H new ATOM 0 HB1 ALA A 265 -4.892 -4.262 9.902 1.00 0.00 H new ATOM 0 HB2 ALA A 265 -4.242 -2.835 9.059 1.00 0.00 H new ATOM 0 HB3 ALA A 265 -5.824 -3.502 8.590 1.00 0.00 H new ATOM 743 N ALA A 266 -5.520 -6.207 6.716 1.00 0.00 N ATOM 744 CA ALA A 266 -6.237 -7.429 6.481 1.00 0.00 C ATOM 745 C ALA A 266 -5.267 -8.577 6.220 1.00 0.00 C ATOM 746 O ALA A 266 -4.239 -8.406 5.580 1.00 0.00 O ATOM 747 CB ALA A 266 -7.211 -7.268 5.333 1.00 0.00 C ATOM 0 H ALA A 266 -5.561 -5.543 5.943 1.00 0.00 H new ATOM 0 HA ALA A 266 -6.812 -7.668 7.376 1.00 0.00 H new ATOM 0 HB1 ALA A 266 -7.743 -8.206 5.173 1.00 0.00 H new ATOM 0 HB2 ALA A 266 -7.927 -6.481 5.571 1.00 0.00 H new ATOM 0 HB3 ALA A 266 -6.666 -7.001 4.428 1.00 0.00 H new ATOM 753 N SER A 267 -5.585 -9.712 6.758 1.00 0.00 N ATOM 754 CA SER A 267 -4.790 -10.894 6.621 1.00 0.00 C ATOM 755 C SER A 267 -5.448 -11.840 5.604 1.00 0.00 C ATOM 756 O SER A 267 -6.500 -11.509 5.066 1.00 0.00 O ATOM 757 CB SER A 267 -4.732 -11.535 7.979 1.00 0.00 C ATOM 758 OG SER A 267 -6.051 -11.723 8.485 1.00 0.00 O ATOM 0 H SER A 267 -6.426 -9.847 7.319 1.00 0.00 H new ATOM 0 HA SER A 267 -3.787 -10.665 6.262 1.00 0.00 H new ATOM 0 HB2 SER A 267 -4.217 -12.494 7.916 1.00 0.00 H new ATOM 0 HB3 SER A 267 -4.157 -10.909 8.662 1.00 0.00 H new ATOM 0 HG SER A 267 -6.005 -12.143 9.369 1.00 0.00 H new ATOM 764 N ARG A 268 -4.871 -13.041 5.380 1.00 0.00 N ATOM 765 CA ARG A 268 -5.434 -14.004 4.404 1.00 0.00 C ATOM 766 C ARG A 268 -6.873 -14.313 4.721 1.00 0.00 C ATOM 767 O ARG A 268 -7.696 -14.392 3.828 1.00 0.00 O ATOM 768 CB ARG A 268 -4.660 -15.323 4.367 1.00 0.00 C ATOM 769 CG ARG A 268 -3.221 -15.189 3.973 1.00 0.00 C ATOM 770 CD ARG A 268 -2.502 -16.517 3.916 1.00 0.00 C ATOM 771 NE ARG A 268 -2.604 -17.287 5.156 1.00 0.00 N ATOM 772 CZ ARG A 268 -1.837 -18.339 5.466 1.00 0.00 C ATOM 773 NH1 ARG A 268 -0.814 -18.675 4.689 1.00 0.00 N ATOM 774 NH2 ARG A 268 -2.094 -19.037 6.562 1.00 0.00 N ATOM 0 H ARG A 268 -4.028 -13.365 5.854 1.00 0.00 H new ATOM 0 HA ARG A 268 -5.353 -13.522 3.430 1.00 0.00 H new ATOM 0 HB2 ARG A 268 -4.712 -15.788 5.352 1.00 0.00 H new ATOM 0 HB3 ARG A 268 -5.153 -15.999 3.669 1.00 0.00 H new ATOM 0 HG2 ARG A 268 -3.160 -14.706 2.998 1.00 0.00 H new ATOM 0 HG3 ARG A 268 -2.714 -14.537 4.684 1.00 0.00 H new ATOM 0 HD2 ARG A 268 -2.910 -17.108 3.096 1.00 0.00 H new ATOM 0 HD3 ARG A 268 -1.450 -16.343 3.691 1.00 0.00 H new ATOM 0 HE ARG A 268 -3.311 -17.001 5.833 1.00 0.00 H new ATOM 0 HH11 ARG A 268 -0.609 -18.130 3.851 1.00 0.00 H new ATOM 0 HH12 ARG A 268 -0.233 -19.478 4.930 1.00 0.00 H new ATOM 0 HH21 ARG A 268 -2.873 -18.772 7.165 1.00 0.00 H new ATOM 0 HH22 ARG A 268 -1.513 -19.840 6.803 1.00 0.00 H new ATOM 788 N GLU A 269 -7.164 -14.482 5.984 1.00 0.00 N ATOM 789 CA GLU A 269 -8.489 -14.775 6.409 1.00 0.00 C ATOM 790 C GLU A 269 -9.377 -13.548 6.324 1.00 0.00 C ATOM 791 O GLU A 269 -10.510 -13.645 5.890 1.00 0.00 O ATOM 792 CB GLU A 269 -8.484 -15.369 7.804 1.00 0.00 C ATOM 793 CG GLU A 269 -9.861 -15.594 8.363 1.00 0.00 C ATOM 794 CD GLU A 269 -9.838 -16.323 9.651 1.00 0.00 C ATOM 795 OE1 GLU A 269 -9.302 -15.805 10.634 1.00 0.00 O ATOM 796 OE2 GLU A 269 -10.338 -17.457 9.705 1.00 0.00 O ATOM 0 H GLU A 269 -6.482 -14.418 6.740 1.00 0.00 H new ATOM 0 HA GLU A 269 -8.907 -15.521 5.733 1.00 0.00 H new ATOM 0 HB2 GLU A 269 -7.948 -16.318 7.785 1.00 0.00 H new ATOM 0 HB3 GLU A 269 -7.933 -14.706 8.471 1.00 0.00 H new ATOM 0 HG2 GLU A 269 -10.355 -14.632 8.502 1.00 0.00 H new ATOM 0 HG3 GLU A 269 -10.455 -16.156 7.642 1.00 0.00 H new ATOM 803 N ASP A 270 -8.838 -12.395 6.677 1.00 0.00 N ATOM 804 CA ASP A 270 -9.618 -11.152 6.668 1.00 0.00 C ATOM 805 C ASP A 270 -10.016 -10.800 5.219 1.00 0.00 C ATOM 806 O ASP A 270 -11.105 -10.303 4.955 1.00 0.00 O ATOM 807 CB ASP A 270 -8.835 -10.028 7.351 1.00 0.00 C ATOM 808 CG ASP A 270 -9.686 -8.853 7.808 1.00 0.00 C ATOM 809 OD1 ASP A 270 -10.887 -9.018 8.063 1.00 0.00 O ATOM 810 OD2 ASP A 270 -9.130 -7.753 8.011 1.00 0.00 O ATOM 0 H ASP A 270 -7.868 -12.284 6.974 1.00 0.00 H new ATOM 0 HA ASP A 270 -10.537 -11.287 7.238 1.00 0.00 H new ATOM 0 HB2 ASP A 270 -8.313 -10.439 8.215 1.00 0.00 H new ATOM 0 HB3 ASP A 270 -8.073 -9.662 6.662 1.00 0.00 H new ATOM 815 N LEU A 271 -9.139 -11.099 4.269 1.00 0.00 N ATOM 816 CA LEU A 271 -9.511 -10.989 2.865 1.00 0.00 C ATOM 817 C LEU A 271 -10.484 -12.125 2.461 1.00 0.00 C ATOM 818 O LEU A 271 -11.445 -11.907 1.762 1.00 0.00 O ATOM 819 CB LEU A 271 -8.296 -10.969 1.890 1.00 0.00 C ATOM 820 CG LEU A 271 -7.447 -9.680 1.750 1.00 0.00 C ATOM 821 CD1 LEU A 271 -8.297 -8.432 1.680 1.00 0.00 C ATOM 822 CD2 LEU A 271 -6.356 -9.566 2.785 1.00 0.00 C ATOM 0 H LEU A 271 -8.184 -11.413 4.440 1.00 0.00 H new ATOM 0 HA LEU A 271 -10.006 -10.022 2.771 1.00 0.00 H new ATOM 0 HB2 LEU A 271 -7.623 -11.772 2.192 1.00 0.00 H new ATOM 0 HB3 LEU A 271 -8.670 -11.222 0.898 1.00 0.00 H new ATOM 0 HG LEU A 271 -6.939 -9.771 0.790 1.00 0.00 H new ATOM 0 HD11 LEU A 271 -7.653 -7.558 1.582 1.00 0.00 H new ATOM 0 HD12 LEU A 271 -8.961 -8.492 0.817 1.00 0.00 H new ATOM 0 HD13 LEU A 271 -8.891 -8.345 2.590 1.00 0.00 H new ATOM 0 HD21 LEU A 271 -5.801 -8.641 2.628 1.00 0.00 H new ATOM 0 HD22 LEU A 271 -6.799 -9.559 3.781 1.00 0.00 H new ATOM 0 HD23 LEU A 271 -5.679 -10.415 2.695 1.00 0.00 H new ATOM 834 N ALA A 272 -10.265 -13.319 2.964 1.00 0.00 N ATOM 835 CA ALA A 272 -11.051 -14.482 2.537 1.00 0.00 C ATOM 836 C ALA A 272 -12.480 -14.459 3.068 1.00 0.00 C ATOM 837 O ALA A 272 -13.370 -15.083 2.491 1.00 0.00 O ATOM 838 CB ALA A 272 -10.368 -15.776 2.925 1.00 0.00 C ATOM 0 H ALA A 272 -9.555 -13.522 3.667 1.00 0.00 H new ATOM 0 HA ALA A 272 -11.111 -14.425 1.450 1.00 0.00 H new ATOM 0 HB1 ALA A 272 -10.974 -16.620 2.596 1.00 0.00 H new ATOM 0 HB2 ALA A 272 -9.388 -15.826 2.451 1.00 0.00 H new ATOM 0 HB3 ALA A 272 -10.250 -15.815 4.008 1.00 0.00 H new ATOM 844 N LEU A 273 -12.700 -13.756 4.162 1.00 0.00 N ATOM 845 CA LEU A 273 -14.029 -13.638 4.742 1.00 0.00 C ATOM 846 C LEU A 273 -14.883 -12.628 3.990 1.00 0.00 C ATOM 847 O LEU A 273 -16.084 -12.491 4.253 1.00 0.00 O ATOM 848 CB LEU A 273 -13.954 -13.344 6.256 1.00 0.00 C ATOM 849 CG LEU A 273 -13.149 -12.115 6.702 1.00 0.00 C ATOM 850 CD1 LEU A 273 -13.844 -10.812 6.366 1.00 0.00 C ATOM 851 CD2 LEU A 273 -12.821 -12.190 8.173 1.00 0.00 C ATOM 0 H LEU A 273 -11.973 -13.254 4.671 1.00 0.00 H new ATOM 0 HA LEU A 273 -14.528 -14.601 4.633 1.00 0.00 H new ATOM 0 HB2 LEU A 273 -14.973 -13.231 6.627 1.00 0.00 H new ATOM 0 HB3 LEU A 273 -13.530 -14.220 6.748 1.00 0.00 H new ATOM 0 HG LEU A 273 -12.216 -12.127 6.139 1.00 0.00 H new ATOM 0 HD11 LEU A 273 -13.232 -9.976 6.703 1.00 0.00 H new ATOM 0 HD12 LEU A 273 -13.989 -10.744 5.288 1.00 0.00 H new ATOM 0 HD13 LEU A 273 -14.812 -10.777 6.865 1.00 0.00 H new ATOM 0 HD21 LEU A 273 -12.251 -11.308 8.464 1.00 0.00 H new ATOM 0 HD22 LEU A 273 -13.745 -12.231 8.750 1.00 0.00 H new ATOM 0 HD23 LEU A 273 -12.230 -13.085 8.369 1.00 0.00 H new ATOM 863 N CYS A 274 -14.255 -11.917 3.072 1.00 0.00 N ATOM 864 CA CYS A 274 -14.941 -10.967 2.233 1.00 0.00 C ATOM 865 C CYS A 274 -16.025 -11.679 1.402 1.00 0.00 C ATOM 866 O CYS A 274 -15.875 -12.862 1.060 1.00 0.00 O ATOM 867 CB CYS A 274 -13.935 -10.205 1.375 1.00 0.00 C ATOM 868 SG CYS A 274 -12.830 -9.165 2.353 1.00 0.00 S ATOM 0 H CYS A 274 -13.254 -11.986 2.891 1.00 0.00 H new ATOM 0 HA CYS A 274 -15.453 -10.229 2.850 1.00 0.00 H new ATOM 0 HB2 CYS A 274 -13.343 -10.916 0.799 1.00 0.00 H new ATOM 0 HB3 CYS A 274 -14.472 -9.584 0.658 1.00 0.00 H new ATOM 0 HG CYS A 274 -12.311 -9.868 3.315 1.00 0.00 H new ATOM 874 N PRO A 275 -17.112 -10.961 1.058 1.00 0.00 N ATOM 875 CA PRO A 275 -18.333 -11.549 0.471 1.00 0.00 C ATOM 876 C PRO A 275 -18.106 -12.349 -0.820 1.00 0.00 C ATOM 877 O PRO A 275 -18.775 -13.366 -1.062 1.00 0.00 O ATOM 878 CB PRO A 275 -19.229 -10.323 0.229 1.00 0.00 C ATOM 879 CG PRO A 275 -18.292 -9.180 0.180 1.00 0.00 C ATOM 880 CD PRO A 275 -17.242 -9.500 1.189 1.00 0.00 C ATOM 0 HA PRO A 275 -18.767 -12.296 1.136 1.00 0.00 H new ATOM 0 HB2 PRO A 275 -19.788 -10.418 -0.702 1.00 0.00 H new ATOM 0 HB3 PRO A 275 -19.960 -10.202 1.028 1.00 0.00 H new ATOM 0 HG2 PRO A 275 -17.862 -9.065 -0.815 1.00 0.00 H new ATOM 0 HG3 PRO A 275 -18.798 -8.244 0.419 1.00 0.00 H new ATOM 0 HD2 PRO A 275 -16.304 -8.988 0.975 1.00 0.00 H new ATOM 0 HD3 PRO A 275 -17.543 -9.208 2.195 1.00 0.00 H new ATOM 888 N GLY A 276 -17.165 -11.927 -1.620 1.00 0.00 N ATOM 889 CA GLY A 276 -16.894 -12.623 -2.836 1.00 0.00 C ATOM 890 C GLY A 276 -15.457 -12.532 -3.215 1.00 0.00 C ATOM 891 O GLY A 276 -15.114 -11.856 -4.183 1.00 0.00 O ATOM 0 H GLY A 276 -16.580 -11.110 -1.449 1.00 0.00 H new ATOM 0 HA2 GLY A 276 -17.176 -13.670 -2.726 1.00 0.00 H new ATOM 0 HA3 GLY A 276 -17.508 -12.210 -3.636 1.00 0.00 H new ATOM 895 N LEU A 277 -14.605 -13.185 -2.457 1.00 0.00 N ATOM 896 CA LEU A 277 -13.196 -13.166 -2.753 1.00 0.00 C ATOM 897 C LEU A 277 -12.619 -14.563 -2.927 1.00 0.00 C ATOM 898 O LEU A 277 -12.575 -15.091 -4.047 1.00 0.00 O ATOM 899 CB LEU A 277 -12.394 -12.323 -1.734 1.00 0.00 C ATOM 900 CG LEU A 277 -10.866 -12.326 -1.910 1.00 0.00 C ATOM 901 CD1 LEU A 277 -10.504 -12.027 -3.327 1.00 0.00 C ATOM 902 CD2 LEU A 277 -10.234 -11.306 -1.023 1.00 0.00 C ATOM 0 H LEU A 277 -14.864 -13.732 -1.636 1.00 0.00 H new ATOM 0 HA LEU A 277 -13.092 -12.669 -3.718 1.00 0.00 H new ATOM 0 HB2 LEU A 277 -12.744 -11.292 -1.790 1.00 0.00 H new ATOM 0 HB3 LEU A 277 -12.625 -12.684 -0.732 1.00 0.00 H new ATOM 0 HG LEU A 277 -10.500 -13.317 -1.641 1.00 0.00 H new ATOM 0 HD11 LEU A 277 -9.419 -12.033 -3.434 1.00 0.00 H new ATOM 0 HD12 LEU A 277 -10.938 -12.784 -3.981 1.00 0.00 H new ATOM 0 HD13 LEU A 277 -10.890 -11.046 -3.602 1.00 0.00 H new ATOM 0 HD21 LEU A 277 -9.153 -11.323 -1.162 1.00 0.00 H new ATOM 0 HD22 LEU A 277 -10.617 -10.317 -1.275 1.00 0.00 H new ATOM 0 HD23 LEU A 277 -10.470 -11.532 0.017 1.00 0.00 H new ATOM 914 N GLY A 278 -12.196 -15.150 -1.846 1.00 0.00 N ATOM 915 CA GLY A 278 -11.618 -16.452 -1.902 1.00 0.00 C ATOM 916 C GLY A 278 -10.158 -16.439 -1.495 1.00 0.00 C ATOM 917 O GLY A 278 -9.404 -15.529 -1.895 1.00 0.00 O ATOM 0 H GLY A 278 -12.243 -14.742 -0.912 1.00 0.00 H new ATOM 0 HA2 GLY A 278 -12.172 -17.124 -1.246 1.00 0.00 H new ATOM 0 HA3 GLY A 278 -11.710 -16.847 -2.914 1.00 0.00 H new ATOM 921 N PRO A 279 -9.731 -17.430 -0.691 1.00 0.00 N ATOM 922 CA PRO A 279 -8.361 -17.560 -0.189 1.00 0.00 C ATOM 923 C PRO A 279 -7.255 -17.401 -1.244 1.00 0.00 C ATOM 924 O PRO A 279 -6.213 -16.858 -0.928 1.00 0.00 O ATOM 925 CB PRO A 279 -8.306 -18.962 0.432 1.00 0.00 C ATOM 926 CG PRO A 279 -9.613 -19.601 0.120 1.00 0.00 C ATOM 927 CD PRO A 279 -10.583 -18.500 -0.147 1.00 0.00 C ATOM 0 HA PRO A 279 -8.159 -16.750 0.512 1.00 0.00 H new ATOM 0 HB2 PRO A 279 -7.480 -19.540 0.017 1.00 0.00 H new ATOM 0 HB3 PRO A 279 -8.147 -18.906 1.509 1.00 0.00 H new ATOM 0 HG2 PRO A 279 -9.525 -20.256 -0.747 1.00 0.00 H new ATOM 0 HG3 PRO A 279 -9.949 -20.218 0.953 1.00 0.00 H new ATOM 0 HD2 PRO A 279 -11.352 -18.804 -0.857 1.00 0.00 H new ATOM 0 HD3 PRO A 279 -11.095 -18.185 0.762 1.00 0.00 H new ATOM 935 N GLN A 280 -7.499 -17.828 -2.479 1.00 0.00 N ATOM 936 CA GLN A 280 -6.485 -17.750 -3.556 1.00 0.00 C ATOM 937 C GLN A 280 -5.933 -16.306 -3.737 1.00 0.00 C ATOM 938 O GLN A 280 -4.708 -16.048 -3.642 1.00 0.00 O ATOM 939 CB GLN A 280 -7.110 -18.273 -4.880 1.00 0.00 C ATOM 940 CG GLN A 280 -8.455 -17.631 -5.242 1.00 0.00 C ATOM 941 CD GLN A 280 -9.069 -18.179 -6.508 1.00 0.00 C ATOM 942 OE1 GLN A 280 -9.825 -19.140 -6.479 1.00 0.00 O ATOM 943 NE2 GLN A 280 -8.764 -17.573 -7.616 1.00 0.00 N ATOM 0 H GLN A 280 -8.388 -18.234 -2.771 1.00 0.00 H new ATOM 0 HA GLN A 280 -5.636 -18.375 -3.277 1.00 0.00 H new ATOM 0 HB2 GLN A 280 -6.407 -18.097 -5.694 1.00 0.00 H new ATOM 0 HB3 GLN A 280 -7.245 -19.352 -4.803 1.00 0.00 H new ATOM 0 HG2 GLN A 280 -9.152 -17.779 -4.417 1.00 0.00 H new ATOM 0 HG3 GLN A 280 -8.316 -16.556 -5.352 1.00 0.00 H new ATOM 0 HE21 GLN A 280 -8.130 -16.774 -7.603 1.00 0.00 H new ATOM 0 HE22 GLN A 280 -9.159 -17.896 -8.499 1.00 0.00 H new ATOM 952 N LYS A 281 -6.831 -15.372 -3.908 1.00 0.00 N ATOM 953 CA LYS A 281 -6.483 -13.997 -4.077 1.00 0.00 C ATOM 954 C LYS A 281 -5.993 -13.394 -2.779 1.00 0.00 C ATOM 955 O LYS A 281 -5.062 -12.590 -2.771 1.00 0.00 O ATOM 956 CB LYS A 281 -7.663 -13.269 -4.652 1.00 0.00 C ATOM 957 CG LYS A 281 -7.883 -13.579 -6.116 1.00 0.00 C ATOM 958 CD LYS A 281 -9.222 -13.119 -6.619 1.00 0.00 C ATOM 959 CE LYS A 281 -10.336 -14.059 -6.213 1.00 0.00 C ATOM 960 NZ LYS A 281 -11.647 -13.554 -6.663 1.00 0.00 N ATOM 0 H LYS A 281 -7.835 -15.553 -3.933 1.00 0.00 H new ATOM 0 HA LYS A 281 -5.652 -13.904 -4.776 1.00 0.00 H new ATOM 0 HB2 LYS A 281 -8.558 -13.535 -4.090 1.00 0.00 H new ATOM 0 HB3 LYS A 281 -7.517 -12.196 -4.530 1.00 0.00 H new ATOM 0 HG2 LYS A 281 -7.098 -13.104 -6.704 1.00 0.00 H new ATOM 0 HG3 LYS A 281 -7.792 -14.654 -6.272 1.00 0.00 H new ATOM 0 HD2 LYS A 281 -9.431 -12.122 -6.232 1.00 0.00 H new ATOM 0 HD3 LYS A 281 -9.193 -13.040 -7.706 1.00 0.00 H new ATOM 0 HE2 LYS A 281 -10.157 -15.046 -6.640 1.00 0.00 H new ATOM 0 HE3 LYS A 281 -10.340 -14.176 -5.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 281 -12.383 -13.855 -5.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 281 -11.622 -12.515 -6.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 281 -11.861 -13.935 -7.607 1.00 0.00 H new ATOM 974 N ALA A 282 -6.594 -13.841 -1.687 1.00 0.00 N ATOM 975 CA ALA A 282 -6.241 -13.393 -0.353 1.00 0.00 C ATOM 976 C ALA A 282 -4.781 -13.707 -0.040 1.00 0.00 C ATOM 977 O ALA A 282 -4.087 -12.895 0.525 1.00 0.00 O ATOM 978 CB ALA A 282 -7.149 -14.045 0.668 1.00 0.00 C ATOM 0 H ALA A 282 -7.346 -14.530 -1.704 1.00 0.00 H new ATOM 0 HA ALA A 282 -6.371 -12.312 -0.307 1.00 0.00 H new ATOM 0 HB1 ALA A 282 -6.878 -13.704 1.667 1.00 0.00 H new ATOM 0 HB2 ALA A 282 -8.184 -13.773 0.460 1.00 0.00 H new ATOM 0 HB3 ALA A 282 -7.040 -15.128 0.613 1.00 0.00 H new ATOM 984 N ARG A 283 -4.329 -14.897 -0.427 1.00 0.00 N ATOM 985 CA ARG A 283 -2.933 -15.305 -0.240 1.00 0.00 C ATOM 986 C ARG A 283 -1.995 -14.421 -1.023 1.00 0.00 C ATOM 987 O ARG A 283 -0.976 -13.972 -0.501 1.00 0.00 O ATOM 988 CB ARG A 283 -2.693 -16.765 -0.654 1.00 0.00 C ATOM 989 CG ARG A 283 -2.805 -17.782 0.462 1.00 0.00 C ATOM 990 CD ARG A 283 -4.203 -17.889 1.035 1.00 0.00 C ATOM 991 NE ARG A 283 -4.272 -18.882 2.108 1.00 0.00 N ATOM 992 CZ ARG A 283 -5.265 -18.998 3.008 1.00 0.00 C ATOM 993 NH1 ARG A 283 -6.292 -18.138 3.002 1.00 0.00 N ATOM 994 NH2 ARG A 283 -5.222 -19.963 3.914 1.00 0.00 N ATOM 0 H ARG A 283 -4.912 -15.603 -0.876 1.00 0.00 H new ATOM 0 HA ARG A 283 -2.731 -15.205 0.826 1.00 0.00 H new ATOM 0 HB2 ARG A 283 -3.408 -17.026 -1.434 1.00 0.00 H new ATOM 0 HB3 ARG A 283 -1.699 -16.842 -1.094 1.00 0.00 H new ATOM 0 HG2 ARG A 283 -2.497 -18.758 0.087 1.00 0.00 H new ATOM 0 HG3 ARG A 283 -2.112 -17.514 1.260 1.00 0.00 H new ATOM 0 HD2 ARG A 283 -4.515 -16.917 1.417 1.00 0.00 H new ATOM 0 HD3 ARG A 283 -4.902 -18.159 0.243 1.00 0.00 H new ATOM 0 HE ARG A 283 -3.499 -19.544 2.180 1.00 0.00 H new ATOM 0 HH11 ARG A 283 -6.325 -17.388 2.311 1.00 0.00 H new ATOM 0 HH12 ARG A 283 -7.041 -18.233 3.688 1.00 0.00 H new ATOM 0 HH21 ARG A 283 -4.438 -20.615 3.928 1.00 0.00 H new ATOM 0 HH22 ARG A 283 -5.973 -20.054 4.598 1.00 0.00 H new ATOM 1008 N ARG A 284 -2.337 -14.169 -2.261 1.00 0.00 N ATOM 1009 CA ARG A 284 -1.488 -13.358 -3.112 1.00 0.00 C ATOM 1010 C ARG A 284 -1.432 -11.899 -2.661 1.00 0.00 C ATOM 1011 O ARG A 284 -0.365 -11.286 -2.665 1.00 0.00 O ATOM 1012 CB ARG A 284 -1.882 -13.535 -4.571 1.00 0.00 C ATOM 1013 CG ARG A 284 -1.644 -14.963 -5.007 1.00 0.00 C ATOM 1014 CD ARG A 284 -2.155 -15.281 -6.388 1.00 0.00 C ATOM 1015 NE ARG A 284 -1.884 -16.695 -6.688 1.00 0.00 N ATOM 1016 CZ ARG A 284 -2.775 -17.607 -7.094 1.00 0.00 C ATOM 1017 NH1 ARG A 284 -3.970 -17.231 -7.517 1.00 0.00 N ATOM 1018 NH2 ARG A 284 -2.428 -18.887 -7.136 1.00 0.00 N ATOM 0 H ARG A 284 -3.190 -14.509 -2.705 1.00 0.00 H new ATOM 0 HA ARG A 284 -0.462 -13.713 -3.014 1.00 0.00 H new ATOM 0 HB2 ARG A 284 -2.932 -13.276 -4.705 1.00 0.00 H new ATOM 0 HB3 ARG A 284 -1.304 -12.855 -5.196 1.00 0.00 H new ATOM 0 HG2 ARG A 284 -0.574 -15.168 -4.972 1.00 0.00 H new ATOM 0 HG3 ARG A 284 -2.121 -15.633 -4.292 1.00 0.00 H new ATOM 0 HD2 ARG A 284 -3.225 -15.082 -6.448 1.00 0.00 H new ATOM 0 HD3 ARG A 284 -1.670 -14.641 -7.125 1.00 0.00 H new ATOM 0 HE ARG A 284 -0.921 -17.012 -6.575 1.00 0.00 H new ATOM 0 HH11 ARG A 284 -4.217 -16.241 -7.535 1.00 0.00 H new ATOM 0 HH12 ARG A 284 -4.645 -17.931 -7.825 1.00 0.00 H new ATOM 0 HH21 ARG A 284 -1.488 -19.170 -6.860 1.00 0.00 H new ATOM 0 HH22 ARG A 284 -3.102 -19.588 -7.444 1.00 0.00 H new ATOM 1032 N LEU A 285 -2.554 -11.365 -2.216 1.00 0.00 N ATOM 1033 CA LEU A 285 -2.590 -10.003 -1.716 1.00 0.00 C ATOM 1034 C LEU A 285 -1.898 -9.951 -0.348 1.00 0.00 C ATOM 1035 O LEU A 285 -1.222 -9.007 -0.042 1.00 0.00 O ATOM 1036 CB LEU A 285 -4.036 -9.517 -1.650 1.00 0.00 C ATOM 1037 CG LEU A 285 -4.252 -7.995 -1.464 1.00 0.00 C ATOM 1038 CD1 LEU A 285 -3.425 -7.181 -2.450 1.00 0.00 C ATOM 1039 CD2 LEU A 285 -5.702 -7.634 -1.648 1.00 0.00 C ATOM 0 H LEU A 285 -3.450 -11.852 -2.190 1.00 0.00 H new ATOM 0 HA LEU A 285 -2.053 -9.335 -2.389 1.00 0.00 H new ATOM 0 HB2 LEU A 285 -4.539 -9.822 -2.567 1.00 0.00 H new ATOM 0 HB3 LEU A 285 -4.531 -10.034 -0.828 1.00 0.00 H new ATOM 0 HG LEU A 285 -3.932 -7.757 -0.449 1.00 0.00 H new ATOM 0 HD11 LEU A 285 -3.605 -6.119 -2.286 1.00 0.00 H new ATOM 0 HD12 LEU A 285 -2.367 -7.396 -2.302 1.00 0.00 H new ATOM 0 HD13 LEU A 285 -3.710 -7.444 -3.469 1.00 0.00 H new ATOM 0 HD21 LEU A 285 -5.830 -6.560 -1.513 1.00 0.00 H new ATOM 0 HD22 LEU A 285 -6.022 -7.914 -2.652 1.00 0.00 H new ATOM 0 HD23 LEU A 285 -6.306 -8.166 -0.913 1.00 0.00 H new ATOM 1051 N PHE A 286 -2.039 -11.011 0.440 1.00 0.00 N ATOM 1052 CA PHE A 286 -1.308 -11.136 1.718 1.00 0.00 C ATOM 1053 C PHE A 286 0.184 -11.048 1.445 1.00 0.00 C ATOM 1054 O PHE A 286 0.915 -10.385 2.147 1.00 0.00 O ATOM 1055 CB PHE A 286 -1.630 -12.499 2.354 1.00 0.00 C ATOM 1056 CG PHE A 286 -0.918 -12.827 3.650 1.00 0.00 C ATOM 1057 CD1 PHE A 286 0.306 -13.482 3.644 1.00 0.00 C ATOM 1058 CD2 PHE A 286 -1.495 -12.519 4.867 1.00 0.00 C ATOM 1059 CE1 PHE A 286 0.937 -13.815 4.823 1.00 0.00 C ATOM 1060 CE2 PHE A 286 -0.867 -12.849 6.051 1.00 0.00 C ATOM 1061 CZ PHE A 286 0.351 -13.497 6.029 1.00 0.00 C ATOM 0 H PHE A 286 -2.649 -11.800 0.226 1.00 0.00 H new ATOM 0 HA PHE A 286 -1.607 -10.337 2.396 1.00 0.00 H new ATOM 0 HB2 PHE A 286 -2.704 -12.546 2.534 1.00 0.00 H new ATOM 0 HB3 PHE A 286 -1.394 -13.278 1.629 1.00 0.00 H new ATOM 0 HD1 PHE A 286 0.770 -13.734 2.702 1.00 0.00 H new ATOM 0 HD2 PHE A 286 -2.449 -12.014 4.892 1.00 0.00 H new ATOM 0 HE1 PHE A 286 1.889 -14.324 4.802 1.00 0.00 H new ATOM 0 HE2 PHE A 286 -1.329 -12.600 6.995 1.00 0.00 H new ATOM 0 HZ PHE A 286 0.844 -13.754 6.955 1.00 0.00 H new ATOM 1071 N ASP A 287 0.611 -11.687 0.385 1.00 0.00 N ATOM 1072 CA ASP A 287 2.021 -11.708 0.036 1.00 0.00 C ATOM 1073 C ASP A 287 2.486 -10.292 -0.205 1.00 0.00 C ATOM 1074 O ASP A 287 3.405 -9.849 0.422 1.00 0.00 O ATOM 1075 CB ASP A 287 2.263 -12.550 -1.208 1.00 0.00 C ATOM 1076 CG ASP A 287 3.556 -13.309 -1.180 1.00 0.00 C ATOM 1077 OD1 ASP A 287 3.580 -14.408 -0.584 1.00 0.00 O ATOM 1078 OD2 ASP A 287 4.550 -12.870 -1.802 1.00 0.00 O ATOM 0 H ASP A 287 0.007 -12.202 -0.256 1.00 0.00 H new ATOM 0 HA ASP A 287 2.582 -12.153 0.858 1.00 0.00 H new ATOM 0 HB2 ASP A 287 1.440 -13.255 -1.324 1.00 0.00 H new ATOM 0 HB3 ASP A 287 2.252 -11.901 -2.083 1.00 0.00 H new ATOM 1083 N VAL A 288 1.774 -9.550 -1.036 1.00 0.00 N ATOM 1084 CA VAL A 288 2.164 -8.184 -1.310 1.00 0.00 C ATOM 1085 C VAL A 288 2.066 -7.297 -0.081 1.00 0.00 C ATOM 1086 O VAL A 288 2.857 -6.400 0.073 1.00 0.00 O ATOM 1087 CB VAL A 288 1.446 -7.535 -2.512 1.00 0.00 C ATOM 1088 CG1 VAL A 288 1.781 -8.220 -3.804 1.00 0.00 C ATOM 1089 CG2 VAL A 288 -0.017 -7.494 -2.349 1.00 0.00 C ATOM 0 H VAL A 288 0.936 -9.867 -1.524 1.00 0.00 H new ATOM 0 HA VAL A 288 3.212 -8.263 -1.598 1.00 0.00 H new ATOM 0 HB VAL A 288 1.814 -6.510 -2.546 1.00 0.00 H new ATOM 0 HG11 VAL A 288 1.254 -7.730 -4.623 1.00 0.00 H new ATOM 0 HG12 VAL A 288 2.855 -8.163 -3.978 1.00 0.00 H new ATOM 0 HG13 VAL A 288 1.477 -9.266 -3.751 1.00 0.00 H new ATOM 0 HG21 VAL A 288 -0.468 -7.027 -3.225 1.00 0.00 H new ATOM 0 HG22 VAL A 288 -0.400 -8.509 -2.241 1.00 0.00 H new ATOM 0 HG23 VAL A 288 -0.268 -6.916 -1.460 1.00 0.00 H new ATOM 1099 N LEU A 289 1.098 -7.577 0.779 1.00 0.00 N ATOM 1100 CA LEU A 289 0.843 -6.801 1.980 1.00 0.00 C ATOM 1101 C LEU A 289 1.726 -7.176 3.179 1.00 0.00 C ATOM 1102 O LEU A 289 1.627 -6.553 4.245 1.00 0.00 O ATOM 1103 CB LEU A 289 -0.620 -6.900 2.349 1.00 0.00 C ATOM 1104 CG LEU A 289 -1.539 -6.314 1.292 1.00 0.00 C ATOM 1105 CD1 LEU A 289 -2.958 -6.640 1.554 1.00 0.00 C ATOM 1106 CD2 LEU A 289 -1.354 -4.823 1.176 1.00 0.00 C ATOM 0 H LEU A 289 0.458 -8.362 0.659 1.00 0.00 H new ATOM 0 HA LEU A 289 1.108 -5.772 1.739 1.00 0.00 H new ATOM 0 HB2 LEU A 289 -0.879 -7.947 2.508 1.00 0.00 H new ATOM 0 HB3 LEU A 289 -0.786 -6.383 3.294 1.00 0.00 H new ATOM 0 HG LEU A 289 -1.263 -6.771 0.342 1.00 0.00 H new ATOM 0 HD11 LEU A 289 -3.582 -6.202 0.775 1.00 0.00 H new ATOM 0 HD12 LEU A 289 -3.088 -7.722 1.558 1.00 0.00 H new ATOM 0 HD13 LEU A 289 -3.251 -6.236 2.523 1.00 0.00 H new ATOM 0 HD21 LEU A 289 -2.025 -4.431 0.412 1.00 0.00 H new ATOM 0 HD22 LEU A 289 -1.580 -4.353 2.133 1.00 0.00 H new ATOM 0 HD23 LEU A 289 -0.322 -4.605 0.900 1.00 0.00 H new ATOM 1118 N HIS A 290 2.551 -8.191 3.025 1.00 0.00 N ATOM 1119 CA HIS A 290 3.378 -8.677 4.143 1.00 0.00 C ATOM 1120 C HIS A 290 4.853 -8.910 3.776 1.00 0.00 C ATOM 1121 O HIS A 290 5.741 -8.872 4.654 1.00 0.00 O ATOM 1122 CB HIS A 290 2.779 -9.980 4.703 1.00 0.00 C ATOM 1123 CG HIS A 290 1.423 -9.798 5.358 1.00 0.00 C ATOM 1124 ND1 HIS A 290 0.211 -9.565 4.801 1.00 0.00 N flip ATOM 1125 CD2 HIS A 290 1.201 -9.819 6.705 1.00 0.00 C flip ATOM 1126 CE1 HIS A 290 -0.738 -9.439 5.781 1.00 0.00 C flip ATOM 1127 NE2 HIS A 290 -0.104 -9.594 6.897 1.00 0.00 N flip ATOM 0 H HIS A 290 2.676 -8.701 2.150 1.00 0.00 H new ATOM 0 HA HIS A 290 3.368 -7.886 4.893 1.00 0.00 H new ATOM 0 HB2 HIS A 290 2.687 -10.704 3.893 1.00 0.00 H new ATOM 0 HB3 HIS A 290 3.470 -10.403 5.432 1.00 0.00 H new ATOM 0 HD1 HIS A 290 0.031 -9.494 3.800 1.00 0.00 H new ATOM 0 HD2 HIS A 290 1.941 -9.986 7.473 1.00 0.00 H new ATOM 0 HE1 HIS A 290 -1.793 -9.250 5.649 1.00 0.00 H new ATOM 1135 N GLU A 291 5.111 -9.144 2.521 1.00 0.00 N ATOM 1136 CA GLU A 291 6.436 -9.496 2.039 1.00 0.00 C ATOM 1137 C GLU A 291 7.297 -8.218 1.957 1.00 0.00 C ATOM 1138 O GLU A 291 6.782 -7.145 1.633 1.00 0.00 O ATOM 1139 CB GLU A 291 6.251 -10.147 0.659 1.00 0.00 C ATOM 1140 CG GLU A 291 7.284 -11.143 0.209 1.00 0.00 C ATOM 1141 CD GLU A 291 7.486 -12.265 1.204 1.00 0.00 C ATOM 1142 OE1 GLU A 291 6.521 -12.966 1.549 1.00 0.00 O ATOM 1143 OE2 GLU A 291 8.617 -12.457 1.677 1.00 0.00 O ATOM 0 H GLU A 291 4.405 -9.098 1.786 1.00 0.00 H new ATOM 0 HA GLU A 291 6.946 -10.192 2.705 1.00 0.00 H new ATOM 0 HB2 GLU A 291 5.281 -10.644 0.650 1.00 0.00 H new ATOM 0 HB3 GLU A 291 6.208 -9.351 -0.084 1.00 0.00 H new ATOM 0 HG2 GLU A 291 6.983 -11.564 -0.751 1.00 0.00 H new ATOM 0 HG3 GLU A 291 8.232 -10.630 0.049 1.00 0.00 H new ATOM 1150 N PRO A 292 8.606 -8.300 2.276 1.00 0.00 N ATOM 1151 CA PRO A 292 9.490 -7.141 2.247 1.00 0.00 C ATOM 1152 C PRO A 292 9.784 -6.691 0.826 1.00 0.00 C ATOM 1153 O PRO A 292 9.580 -7.445 -0.128 1.00 0.00 O ATOM 1154 CB PRO A 292 10.767 -7.638 2.909 1.00 0.00 C ATOM 1155 CG PRO A 292 10.763 -9.104 2.666 1.00 0.00 C ATOM 1156 CD PRO A 292 9.321 -9.522 2.660 1.00 0.00 C ATOM 0 HA PRO A 292 9.046 -6.281 2.748 1.00 0.00 H new ATOM 0 HB2 PRO A 292 11.649 -7.166 2.476 1.00 0.00 H new ATOM 0 HB3 PRO A 292 10.776 -7.412 3.975 1.00 0.00 H new ATOM 0 HG2 PRO A 292 11.242 -9.343 1.716 1.00 0.00 H new ATOM 0 HG3 PRO A 292 11.318 -9.629 3.444 1.00 0.00 H new ATOM 0 HD2 PRO A 292 9.141 -10.330 1.951 1.00 0.00 H new ATOM 0 HD3 PRO A 292 9.004 -9.880 3.639 1.00 0.00 H new ATOM 1164 N PHE A 293 10.293 -5.491 0.678 1.00 0.00 N ATOM 1165 CA PHE A 293 10.556 -4.972 -0.644 1.00 0.00 C ATOM 1166 C PHE A 293 11.840 -5.535 -1.232 1.00 0.00 C ATOM 1167 O PHE A 293 11.851 -6.029 -2.335 1.00 0.00 O ATOM 1168 CB PHE A 293 10.626 -3.447 -0.649 1.00 0.00 C ATOM 1169 CG PHE A 293 9.394 -2.755 -0.206 1.00 0.00 C ATOM 1170 CD1 PHE A 293 8.276 -2.769 -0.989 1.00 0.00 C ATOM 1171 CD2 PHE A 293 9.363 -2.067 0.985 1.00 0.00 C ATOM 1172 CE1 PHE A 293 7.140 -2.114 -0.602 1.00 0.00 C ATOM 1173 CE2 PHE A 293 8.231 -1.403 1.372 1.00 0.00 C ATOM 1174 CZ PHE A 293 7.119 -1.431 0.577 1.00 0.00 C ATOM 0 H PHE A 293 10.531 -4.862 1.445 1.00 0.00 H new ATOM 0 HA PHE A 293 9.719 -5.290 -1.265 1.00 0.00 H new ATOM 0 HB2 PHE A 293 11.449 -3.136 -0.006 1.00 0.00 H new ATOM 0 HB3 PHE A 293 10.867 -3.114 -1.659 1.00 0.00 H new ATOM 0 HD1 PHE A 293 8.289 -3.305 -1.927 1.00 0.00 H new ATOM 0 HD2 PHE A 293 10.238 -2.051 1.618 1.00 0.00 H new ATOM 0 HE1 PHE A 293 6.261 -2.138 -1.229 1.00 0.00 H new ATOM 0 HE2 PHE A 293 8.216 -0.858 2.304 1.00 0.00 H new ATOM 0 HZ PHE A 293 6.223 -0.911 0.884 1.00 0.00 H new ATOM 1184 N LEU A 294 12.902 -5.494 -0.480 1.00 0.00 N ATOM 1185 CA LEU A 294 14.217 -5.850 -1.015 1.00 0.00 C ATOM 1186 C LEU A 294 14.584 -7.265 -0.647 1.00 0.00 C ATOM 1187 O LEU A 294 15.736 -7.670 -0.832 1.00 0.00 O ATOM 1188 CB LEU A 294 15.274 -4.950 -0.398 1.00 0.00 C ATOM 1189 CG LEU A 294 14.896 -3.485 -0.140 1.00 0.00 C ATOM 1190 CD1 LEU A 294 16.052 -2.755 0.492 1.00 0.00 C ATOM 1191 CD2 LEU A 294 14.465 -2.778 -1.401 1.00 0.00 C ATOM 0 H LEU A 294 12.900 -5.221 0.503 1.00 0.00 H new ATOM 0 HA LEU A 294 14.174 -5.740 -2.099 1.00 0.00 H new ATOM 0 HB2 LEU A 294 15.578 -5.391 0.551 1.00 0.00 H new ATOM 0 HB3 LEU A 294 16.148 -4.962 -1.050 1.00 0.00 H new ATOM 0 HG LEU A 294 14.046 -3.484 0.542 1.00 0.00 H new ATOM 0 HD11 LEU A 294 15.773 -1.717 0.671 1.00 0.00 H new ATOM 0 HD12 LEU A 294 16.308 -3.230 1.439 1.00 0.00 H new ATOM 0 HD13 LEU A 294 16.913 -2.789 -0.176 1.00 0.00 H new ATOM 0 HD21 LEU A 294 14.207 -1.745 -1.169 1.00 0.00 H new ATOM 0 HD22 LEU A 294 15.280 -2.795 -2.124 1.00 0.00 H new ATOM 0 HD23 LEU A 294 13.596 -3.283 -1.822 1.00 0.00 H new ATOM 1203 N LYS A 295 13.611 -8.019 -0.144 1.00 0.00 N ATOM 1204 CA LYS A 295 13.851 -9.340 0.432 1.00 0.00 C ATOM 1205 C LYS A 295 14.673 -9.219 1.704 1.00 0.00 C ATOM 1206 O LYS A 295 14.121 -9.191 2.805 1.00 0.00 O ATOM 1207 CB LYS A 295 14.463 -10.350 -0.575 1.00 0.00 C ATOM 1208 CG LYS A 295 13.430 -11.034 -1.452 1.00 0.00 C ATOM 1209 CD LYS A 295 14.032 -11.878 -2.563 1.00 0.00 C ATOM 1210 CE LYS A 295 14.595 -11.013 -3.673 1.00 0.00 C ATOM 1211 NZ LYS A 295 15.092 -11.818 -4.804 1.00 0.00 N ATOM 0 H LYS A 295 12.632 -7.732 -0.124 1.00 0.00 H new ATOM 0 HA LYS A 295 12.879 -9.760 0.691 1.00 0.00 H new ATOM 0 HB2 LYS A 295 15.179 -9.829 -1.210 1.00 0.00 H new ATOM 0 HB3 LYS A 295 15.019 -11.108 -0.024 1.00 0.00 H new ATOM 0 HG2 LYS A 295 12.799 -11.667 -0.828 1.00 0.00 H new ATOM 0 HG3 LYS A 295 12.783 -10.276 -1.894 1.00 0.00 H new ATOM 0 HD2 LYS A 295 14.822 -12.509 -2.155 1.00 0.00 H new ATOM 0 HD3 LYS A 295 13.271 -12.544 -2.969 1.00 0.00 H new ATOM 0 HE2 LYS A 295 13.823 -10.329 -4.026 1.00 0.00 H new ATOM 0 HE3 LYS A 295 15.407 -10.401 -3.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 295 15.468 -11.187 -5.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 295 15.847 -12.453 -4.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 295 14.312 -12.383 -5.197 1.00 0.00 H new ATOM 1488 N TYR B 833 14.435 -6.647 -6.316 1.00 0.00 N ATOM 1489 CA TYR B 833 13.473 -6.302 -5.271 1.00 0.00 C ATOM 1490 C TYR B 833 12.116 -6.924 -5.605 1.00 0.00 C ATOM 1491 O TYR B 833 11.710 -6.912 -6.769 1.00 0.00 O ATOM 1492 CB TYR B 833 13.351 -4.763 -5.114 1.00 0.00 C ATOM 1493 CG TYR B 833 14.656 -4.044 -4.741 1.00 0.00 C ATOM 1494 CD1 TYR B 833 15.768 -4.748 -4.289 1.00 0.00 C ATOM 1495 CD2 TYR B 833 14.768 -2.655 -4.853 1.00 0.00 C ATOM 1496 CE1 TYR B 833 16.941 -4.109 -3.968 1.00 0.00 C ATOM 1497 CE2 TYR B 833 15.956 -1.999 -4.534 1.00 0.00 C ATOM 1498 CZ TYR B 833 17.040 -2.747 -4.092 1.00 0.00 C ATOM 1499 OH TYR B 833 18.224 -2.136 -3.783 1.00 0.00 O ATOM 0 HA TYR B 833 13.825 -6.701 -4.320 1.00 0.00 H new ATOM 0 HB2 TYR B 833 12.978 -4.346 -6.049 1.00 0.00 H new ATOM 0 HB3 TYR B 833 12.604 -4.549 -4.349 1.00 0.00 H new ATOM 0 HD1 TYR B 833 15.707 -5.822 -4.188 1.00 0.00 H new ATOM 0 HD2 TYR B 833 13.919 -2.080 -5.193 1.00 0.00 H new ATOM 0 HE1 TYR B 833 17.787 -4.681 -3.617 1.00 0.00 H new ATOM 0 HE2 TYR B 833 16.032 -0.926 -4.629 1.00 0.00 H new ATOM 0 HH TYR B 833 18.114 -1.602 -2.969 1.00 0.00 H new ATOM 1509 N ASN B 834 11.443 -7.454 -4.583 1.00 0.00 N ATOM 1510 CA ASN B 834 10.146 -8.148 -4.717 1.00 0.00 C ATOM 1511 C ASN B 834 9.136 -7.273 -5.424 1.00 0.00 C ATOM 1512 O ASN B 834 8.633 -6.301 -4.849 1.00 0.00 O ATOM 1513 CB ASN B 834 9.591 -8.583 -3.345 1.00 0.00 C ATOM 1514 CG ASN B 834 10.353 -9.721 -2.709 1.00 0.00 C ATOM 1515 OD1 ASN B 834 10.909 -10.578 -3.395 1.00 0.00 O ATOM 1516 ND2 ASN B 834 10.388 -9.734 -1.398 1.00 0.00 N ATOM 0 H ASN B 834 11.782 -7.417 -3.622 1.00 0.00 H new ATOM 0 HA ASN B 834 10.321 -9.042 -5.315 1.00 0.00 H new ATOM 0 HB2 ASN B 834 9.606 -7.727 -2.670 1.00 0.00 H new ATOM 0 HB3 ASN B 834 8.548 -8.878 -3.463 1.00 0.00 H new ATOM 0 HD21 ASN B 834 10.890 -10.475 -0.909 1.00 0.00 H new ATOM 0 HD22 ASN B 834 9.913 -9.003 -0.868 1.00 0.00 H new ATOM 1523 N PRO B 835 8.785 -7.637 -6.668 1.00 0.00 N ATOM 1524 CA PRO B 835 7.971 -6.805 -7.550 1.00 0.00 C ATOM 1525 C PRO B 835 6.523 -6.667 -7.106 1.00 0.00 C ATOM 1526 O PRO B 835 5.818 -5.761 -7.551 1.00 0.00 O ATOM 1527 CB PRO B 835 8.064 -7.503 -8.899 1.00 0.00 C ATOM 1528 CG PRO B 835 8.322 -8.921 -8.568 1.00 0.00 C ATOM 1529 CD PRO B 835 9.154 -8.915 -7.317 1.00 0.00 C ATOM 0 HA PRO B 835 8.336 -5.778 -7.560 1.00 0.00 H new ATOM 0 HB2 PRO B 835 7.141 -7.390 -9.468 1.00 0.00 H new ATOM 0 HB3 PRO B 835 8.867 -7.085 -9.507 1.00 0.00 H new ATOM 0 HG2 PRO B 835 7.388 -9.460 -8.412 1.00 0.00 H new ATOM 0 HG3 PRO B 835 8.847 -9.421 -9.382 1.00 0.00 H new ATOM 0 HD2 PRO B 835 8.928 -9.770 -6.680 1.00 0.00 H new ATOM 0 HD3 PRO B 835 10.220 -8.959 -7.542 1.00 0.00 H new ATOM 1537 N GLY B 836 6.090 -7.548 -6.235 1.00 0.00 N ATOM 1538 CA GLY B 836 4.733 -7.493 -5.765 1.00 0.00 C ATOM 1539 C GLY B 836 4.516 -6.385 -4.733 1.00 0.00 C ATOM 1540 O GLY B 836 3.826 -5.407 -5.027 1.00 0.00 O ATOM 0 H GLY B 836 6.654 -8.302 -5.843 1.00 0.00 H new ATOM 0 HA2 GLY B 836 4.065 -7.333 -6.611 1.00 0.00 H new ATOM 0 HA3 GLY B 836 4.465 -8.453 -5.324 1.00 0.00 H new ATOM 1544 N PRO B 837 5.127 -6.481 -3.522 1.00 0.00 N ATOM 1545 CA PRO B 837 4.974 -5.455 -2.480 1.00 0.00 C ATOM 1546 C PRO B 837 5.478 -4.086 -2.929 1.00 0.00 C ATOM 1547 O PRO B 837 4.882 -3.050 -2.582 1.00 0.00 O ATOM 1548 CB PRO B 837 5.831 -5.970 -1.316 1.00 0.00 C ATOM 1549 CG PRO B 837 6.720 -7.001 -1.917 1.00 0.00 C ATOM 1550 CD PRO B 837 5.940 -7.610 -3.040 1.00 0.00 C ATOM 0 HA PRO B 837 3.925 -5.311 -2.222 1.00 0.00 H new ATOM 0 HB2 PRO B 837 6.410 -5.164 -0.866 1.00 0.00 H new ATOM 0 HB3 PRO B 837 5.210 -6.396 -0.527 1.00 0.00 H new ATOM 0 HG2 PRO B 837 7.645 -6.555 -2.281 1.00 0.00 H new ATOM 0 HG3 PRO B 837 6.998 -7.755 -1.180 1.00 0.00 H new ATOM 0 HD2 PRO B 837 6.593 -8.001 -3.821 1.00 0.00 H new ATOM 0 HD3 PRO B 837 5.320 -8.439 -2.699 1.00 0.00 H new ATOM 1558 N GLN B 838 6.570 -4.074 -3.721 1.00 0.00 N ATOM 1559 CA GLN B 838 7.132 -2.820 -4.191 1.00 0.00 C ATOM 1560 C GLN B 838 6.104 -2.064 -5.021 1.00 0.00 C ATOM 1561 O GLN B 838 6.022 -0.863 -4.930 1.00 0.00 O ATOM 1562 CB GLN B 838 8.430 -2.999 -5.026 1.00 0.00 C ATOM 1563 CG GLN B 838 8.221 -3.676 -6.355 1.00 0.00 C ATOM 1564 CD GLN B 838 9.426 -3.614 -7.288 1.00 0.00 C ATOM 1565 OE1 GLN B 838 10.596 -3.467 -6.746 1.00 0.00 O flip ATOM 1566 NE2 GLN B 838 9.280 -3.650 -8.503 1.00 0.00 N flip ATOM 0 H GLN B 838 7.063 -4.910 -4.036 1.00 0.00 H new ATOM 0 HA GLN B 838 7.399 -2.253 -3.299 1.00 0.00 H new ATOM 0 HB2 GLN B 838 8.877 -2.020 -5.196 1.00 0.00 H new ATOM 0 HB3 GLN B 838 9.146 -3.579 -4.444 1.00 0.00 H new ATOM 0 HG2 GLN B 838 7.965 -4.721 -6.181 1.00 0.00 H new ATOM 0 HG3 GLN B 838 7.367 -3.217 -6.853 1.00 0.00 H new ATOM 0 HE21 GLN B 838 8.348 -3.767 -8.901 1.00 0.00 H new ATOM 0 HE22 GLN B 838 10.090 -3.563 -9.117 1.00 0.00 H new ATOM 1575 N ASP B 839 5.257 -2.805 -5.764 1.00 0.00 N ATOM 1576 CA ASP B 839 4.291 -2.193 -6.705 1.00 0.00 C ATOM 1577 C ASP B 839 3.255 -1.465 -5.938 1.00 0.00 C ATOM 1578 O ASP B 839 2.836 -0.385 -6.323 1.00 0.00 O ATOM 1579 CB ASP B 839 3.596 -3.235 -7.569 1.00 0.00 C ATOM 1580 CG ASP B 839 2.807 -2.631 -8.726 1.00 0.00 C ATOM 1581 OD1 ASP B 839 3.340 -1.760 -9.454 1.00 0.00 O ATOM 1582 OD2 ASP B 839 1.620 -3.013 -8.924 1.00 0.00 O ATOM 0 H ASP B 839 5.221 -3.824 -5.733 1.00 0.00 H new ATOM 0 HA ASP B 839 4.851 -1.520 -7.355 1.00 0.00 H new ATOM 0 HB2 ASP B 839 4.342 -3.923 -7.967 1.00 0.00 H new ATOM 0 HB3 ASP B 839 2.921 -3.822 -6.946 1.00 0.00 H new ATOM 1587 N PHE B 840 2.859 -2.055 -4.817 1.00 0.00 N ATOM 1588 CA PHE B 840 1.893 -1.458 -3.946 1.00 0.00 C ATOM 1589 C PHE B 840 2.470 -0.120 -3.437 1.00 0.00 C ATOM 1590 O PHE B 840 1.768 0.880 -3.351 1.00 0.00 O ATOM 1591 CB PHE B 840 1.606 -2.426 -2.779 1.00 0.00 C ATOM 1592 CG PHE B 840 0.252 -2.267 -2.130 1.00 0.00 C ATOM 1593 CD1 PHE B 840 -0.054 -1.158 -1.366 1.00 0.00 C ATOM 1594 CD2 PHE B 840 -0.714 -3.253 -2.284 1.00 0.00 C ATOM 1595 CE1 PHE B 840 -1.301 -1.028 -0.771 1.00 0.00 C ATOM 1596 CE2 PHE B 840 -1.959 -3.127 -1.691 1.00 0.00 C ATOM 1597 CZ PHE B 840 -2.252 -2.021 -0.940 1.00 0.00 C ATOM 0 H PHE B 840 3.207 -2.960 -4.499 1.00 0.00 H new ATOM 0 HA PHE B 840 0.954 -1.265 -4.465 1.00 0.00 H new ATOM 0 HB2 PHE B 840 1.698 -3.449 -3.145 1.00 0.00 H new ATOM 0 HB3 PHE B 840 2.374 -2.290 -2.018 1.00 0.00 H new ATOM 0 HD1 PHE B 840 0.686 -0.383 -1.230 1.00 0.00 H new ATOM 0 HD2 PHE B 840 -0.491 -4.130 -2.874 1.00 0.00 H new ATOM 0 HE1 PHE B 840 -1.529 -0.155 -0.178 1.00 0.00 H new ATOM 0 HE2 PHE B 840 -2.700 -3.902 -1.821 1.00 0.00 H new ATOM 0 HZ PHE B 840 -3.224 -1.922 -0.479 1.00 0.00 H new ATOM 1607 N LEU B 841 3.773 -0.109 -3.148 1.00 0.00 N ATOM 1608 CA LEU B 841 4.431 1.099 -2.687 1.00 0.00 C ATOM 1609 C LEU B 841 4.633 2.117 -3.833 1.00 0.00 C ATOM 1610 O LEU B 841 4.446 3.314 -3.669 1.00 0.00 O ATOM 1611 CB LEU B 841 5.727 0.778 -1.915 1.00 0.00 C ATOM 1612 CG LEU B 841 6.556 1.973 -1.447 1.00 0.00 C ATOM 1613 CD1 LEU B 841 5.695 2.990 -0.754 1.00 0.00 C ATOM 1614 CD2 LEU B 841 7.641 1.544 -0.514 1.00 0.00 C ATOM 0 H LEU B 841 4.384 -0.922 -3.227 1.00 0.00 H new ATOM 0 HA LEU B 841 3.769 1.588 -1.973 1.00 0.00 H new ATOM 0 HB2 LEU B 841 5.465 0.182 -1.041 1.00 0.00 H new ATOM 0 HB3 LEU B 841 6.356 0.154 -2.549 1.00 0.00 H new ATOM 0 HG LEU B 841 7.000 2.420 -2.336 1.00 0.00 H new ATOM 0 HD11 LEU B 841 6.311 3.829 -0.432 1.00 0.00 H new ATOM 0 HD12 LEU B 841 4.928 3.346 -1.441 1.00 0.00 H new ATOM 0 HD13 LEU B 841 5.220 2.534 0.115 1.00 0.00 H new ATOM 0 HD21 LEU B 841 8.214 2.415 -0.198 1.00 0.00 H new ATOM 0 HD22 LEU B 841 7.201 1.063 0.359 1.00 0.00 H new ATOM 0 HD23 LEU B 841 8.301 0.841 -1.022 1.00 0.00 H new ATOM 1626 N LEU B 842 4.995 1.615 -4.984 1.00 0.00 N ATOM 1627 CA LEU B 842 5.235 2.415 -6.186 1.00 0.00 C ATOM 1628 C LEU B 842 3.976 3.114 -6.688 1.00 0.00 C ATOM 1629 O LEU B 842 4.056 4.055 -7.489 1.00 0.00 O ATOM 1630 CB LEU B 842 5.809 1.523 -7.287 1.00 0.00 C ATOM 1631 CG LEU B 842 7.245 1.039 -7.081 1.00 0.00 C ATOM 1632 CD1 LEU B 842 7.431 -0.324 -7.699 1.00 0.00 C ATOM 1633 CD2 LEU B 842 8.226 2.024 -7.696 1.00 0.00 C ATOM 0 H LEU B 842 5.138 0.616 -5.129 1.00 0.00 H new ATOM 0 HA LEU B 842 5.948 3.195 -5.921 1.00 0.00 H new ATOM 0 HB2 LEU B 842 5.165 0.650 -7.392 1.00 0.00 H new ATOM 0 HB3 LEU B 842 5.763 2.069 -8.229 1.00 0.00 H new ATOM 0 HG LEU B 842 7.437 0.971 -6.010 1.00 0.00 H new ATOM 0 HD11 LEU B 842 8.458 -0.656 -7.545 1.00 0.00 H new ATOM 0 HD12 LEU B 842 6.746 -1.032 -7.232 1.00 0.00 H new ATOM 0 HD13 LEU B 842 7.224 -0.270 -8.768 1.00 0.00 H new ATOM 0 HD21 LEU B 842 9.244 1.667 -7.542 1.00 0.00 H new ATOM 0 HD22 LEU B 842 8.030 2.113 -8.765 1.00 0.00 H new ATOM 0 HD23 LEU B 842 8.108 2.999 -7.223 1.00 0.00 H new ATOM 1645 N LYS B 843 2.823 2.692 -6.220 1.00 0.00 N ATOM 1646 CA LYS B 843 1.608 3.276 -6.679 1.00 0.00 C ATOM 1647 C LYS B 843 0.960 4.128 -5.584 1.00 0.00 C ATOM 1648 O LYS B 843 -0.160 4.630 -5.742 1.00 0.00 O ATOM 1649 CB LYS B 843 0.684 2.201 -7.245 1.00 0.00 C ATOM 1650 CG LYS B 843 0.144 1.199 -6.262 1.00 0.00 C ATOM 1651 CD LYS B 843 -0.704 0.175 -6.996 1.00 0.00 C ATOM 1652 CE LYS B 843 0.066 -0.473 -8.140 1.00 0.00 C ATOM 1653 NZ LYS B 843 -0.715 -1.494 -8.866 1.00 0.00 N ATOM 0 H LYS B 843 2.713 1.951 -5.527 1.00 0.00 H new ATOM 0 HA LYS B 843 1.824 3.962 -7.498 1.00 0.00 H new ATOM 0 HB2 LYS B 843 -0.159 2.695 -7.728 1.00 0.00 H new ATOM 0 HB3 LYS B 843 1.224 1.660 -8.022 1.00 0.00 H new ATOM 0 HG2 LYS B 843 0.965 0.703 -5.744 1.00 0.00 H new ATOM 0 HG3 LYS B 843 -0.453 1.704 -5.503 1.00 0.00 H new ATOM 0 HD2 LYS B 843 -1.034 -0.594 -6.297 1.00 0.00 H new ATOM 0 HD3 LYS B 843 -1.600 0.657 -7.387 1.00 0.00 H new ATOM 0 HE2 LYS B 843 0.380 0.300 -8.841 1.00 0.00 H new ATOM 0 HE3 LYS B 843 0.972 -0.932 -7.745 1.00 0.00 H new ATOM 0 HZ1 LYS B 843 -0.115 -2.323 -9.053 1.00 0.00 H new ATOM 0 HZ2 LYS B 843 -1.532 -1.781 -8.290 1.00 0.00 H new ATOM 0 HZ3 LYS B 843 -1.049 -1.099 -9.768 1.00 0.00 H new ATOM 1667 N MET B 844 1.701 4.312 -4.494 1.00 0.00 N ATOM 1668 CA MET B 844 1.295 5.172 -3.387 1.00 0.00 C ATOM 1669 C MET B 844 1.166 6.644 -3.835 1.00 0.00 C ATOM 1670 O MET B 844 1.830 7.070 -4.781 1.00 0.00 O ATOM 1671 CB MET B 844 2.278 5.036 -2.221 1.00 0.00 C ATOM 1672 CG MET B 844 2.111 3.772 -1.406 1.00 0.00 C ATOM 1673 SD MET B 844 0.571 3.769 -0.475 1.00 0.00 S ATOM 1674 CE MET B 844 0.668 2.170 0.306 1.00 0.00 C ATOM 0 H MET B 844 2.607 3.865 -4.354 1.00 0.00 H new ATOM 0 HA MET B 844 0.311 4.848 -3.049 1.00 0.00 H new ATOM 0 HB2 MET B 844 3.294 5.069 -2.613 1.00 0.00 H new ATOM 0 HB3 MET B 844 2.162 5.897 -1.562 1.00 0.00 H new ATOM 0 HG2 MET B 844 2.136 2.907 -2.069 1.00 0.00 H new ATOM 0 HG3 MET B 844 2.951 3.670 -0.718 1.00 0.00 H new ATOM 0 HE1 MET B 844 -0.154 1.545 -0.042 1.00 0.00 H new ATOM 0 HE2 MET B 844 1.616 1.697 0.051 1.00 0.00 H new ATOM 0 HE3 MET B 844 0.601 2.289 1.387 1.00 0.00 H new ATOM 1684 N PRO B 845 0.314 7.438 -3.147 1.00 0.00 N ATOM 1685 CA PRO B 845 -0.005 8.836 -3.530 1.00 0.00 C ATOM 1686 C PRO B 845 1.204 9.796 -3.579 1.00 0.00 C ATOM 1687 O PRO B 845 1.615 10.222 -4.649 1.00 0.00 O ATOM 1688 CB PRO B 845 -0.998 9.271 -2.438 1.00 0.00 C ATOM 1689 CG PRO B 845 -0.700 8.357 -1.305 1.00 0.00 C ATOM 1690 CD PRO B 845 -0.428 7.041 -1.940 1.00 0.00 C ATOM 0 HA PRO B 845 -0.389 8.877 -4.549 1.00 0.00 H new ATOM 0 HB2 PRO B 845 -0.854 10.315 -2.159 1.00 0.00 H new ATOM 0 HB3 PRO B 845 -2.030 9.170 -2.773 1.00 0.00 H new ATOM 0 HG2 PRO B 845 0.159 8.705 -0.732 1.00 0.00 H new ATOM 0 HG3 PRO B 845 -1.541 8.297 -0.614 1.00 0.00 H new ATOM 0 HD2 PRO B 845 0.160 6.389 -1.294 1.00 0.00 H new ATOM 0 HD3 PRO B 845 -1.346 6.506 -2.182 1.00 0.00 H new ATOM 1698 N GLY B 846 1.766 10.109 -2.421 1.00 0.00 N ATOM 1699 CA GLY B 846 2.863 11.059 -2.347 1.00 0.00 C ATOM 1700 C GLY B 846 4.201 10.393 -2.487 1.00 0.00 C ATOM 1701 O GLY B 846 5.241 11.038 -2.453 1.00 0.00 O ATOM 0 H GLY B 846 1.481 9.720 -1.523 1.00 0.00 H new ATOM 0 HA2 GLY B 846 2.747 11.807 -3.132 1.00 0.00 H new ATOM 0 HA3 GLY B 846 2.820 11.587 -1.395 1.00 0.00 H new ATOM 1705 N VAL B 847 4.181 9.108 -2.611 1.00 0.00 N ATOM 1706 CA VAL B 847 5.397 8.384 -2.801 1.00 0.00 C ATOM 1707 C VAL B 847 5.664 8.265 -4.293 1.00 0.00 C ATOM 1708 O VAL B 847 4.889 7.675 -5.035 1.00 0.00 O ATOM 1709 CB VAL B 847 5.355 6.990 -2.164 1.00 0.00 C ATOM 1710 CG1 VAL B 847 6.704 6.330 -2.244 1.00 0.00 C ATOM 1711 CG2 VAL B 847 4.865 7.053 -0.733 1.00 0.00 C ATOM 0 H VAL B 847 3.337 8.536 -2.584 1.00 0.00 H new ATOM 0 HA VAL B 847 6.199 8.932 -2.307 1.00 0.00 H new ATOM 0 HB VAL B 847 4.645 6.385 -2.727 1.00 0.00 H new ATOM 0 HG11 VAL B 847 6.653 5.342 -1.787 1.00 0.00 H new ATOM 0 HG12 VAL B 847 7.000 6.232 -3.289 1.00 0.00 H new ATOM 0 HG13 VAL B 847 7.438 6.937 -1.715 1.00 0.00 H new ATOM 0 HG21 VAL B 847 4.847 6.049 -0.310 1.00 0.00 H new ATOM 0 HG22 VAL B 847 5.535 7.682 -0.146 1.00 0.00 H new ATOM 0 HG23 VAL B 847 3.860 7.474 -0.711 1.00 0.00 H new ATOM 1721 N ASN B 848 6.732 8.855 -4.694 1.00 0.00 N ATOM 1722 CA ASN B 848 7.182 8.908 -6.070 1.00 0.00 C ATOM 1723 C ASN B 848 8.403 8.064 -6.208 1.00 0.00 C ATOM 1724 O ASN B 848 8.858 7.542 -5.217 1.00 0.00 O ATOM 1725 CB ASN B 848 7.449 10.371 -6.496 1.00 0.00 C ATOM 1726 CG ASN B 848 8.114 11.227 -5.426 1.00 0.00 C ATOM 1727 OD1 ASN B 848 7.437 11.753 -4.549 1.00 0.00 O ATOM 1728 ND2 ASN B 848 9.397 11.453 -5.521 1.00 0.00 N ATOM 0 H ASN B 848 7.358 9.343 -4.053 1.00 0.00 H new ATOM 0 HA ASN B 848 6.408 8.518 -6.731 1.00 0.00 H new ATOM 0 HB2 ASN B 848 8.079 10.368 -7.385 1.00 0.00 H new ATOM 0 HB3 ASN B 848 6.503 10.833 -6.777 1.00 0.00 H new ATOM 0 HD21 ASN B 848 9.855 12.078 -4.858 1.00 0.00 H new ATOM 0 HD22 ASN B 848 9.941 11.005 -6.258 1.00 0.00 H new ATOM 1735 N ALA B 849 8.954 7.966 -7.407 1.00 0.00 N ATOM 1736 CA ALA B 849 10.108 7.096 -7.704 1.00 0.00 C ATOM 1737 C ALA B 849 11.247 7.255 -6.726 1.00 0.00 C ATOM 1738 O ALA B 849 11.790 6.263 -6.221 1.00 0.00 O ATOM 1739 CB ALA B 849 10.589 7.330 -9.110 1.00 0.00 C ATOM 0 H ALA B 849 8.619 8.488 -8.217 1.00 0.00 H new ATOM 0 HA ALA B 849 9.756 6.070 -7.601 1.00 0.00 H new ATOM 0 HB1 ALA B 849 11.441 6.682 -9.316 1.00 0.00 H new ATOM 0 HB2 ALA B 849 9.785 7.107 -9.811 1.00 0.00 H new ATOM 0 HB3 ALA B 849 10.890 8.371 -9.223 1.00 0.00 H new ATOM 1745 N LYS B 850 11.549 8.481 -6.404 1.00 0.00 N ATOM 1746 CA LYS B 850 12.661 8.773 -5.511 1.00 0.00 C ATOM 1747 C LYS B 850 12.334 8.319 -4.116 1.00 0.00 C ATOM 1748 O LYS B 850 13.108 7.618 -3.444 1.00 0.00 O ATOM 1749 CB LYS B 850 12.926 10.253 -5.503 1.00 0.00 C ATOM 1750 CG LYS B 850 13.148 10.793 -6.865 1.00 0.00 C ATOM 1751 CD LYS B 850 13.809 12.157 -6.801 1.00 0.00 C ATOM 1752 CE LYS B 850 14.067 12.736 -8.179 1.00 0.00 C ATOM 1753 NZ LYS B 850 14.649 14.088 -8.095 1.00 0.00 N ATOM 0 H LYS B 850 11.047 9.303 -6.741 1.00 0.00 H new ATOM 0 HA LYS B 850 13.546 8.243 -5.863 1.00 0.00 H new ATOM 0 HB2 LYS B 850 12.082 10.768 -5.044 1.00 0.00 H new ATOM 0 HB3 LYS B 850 13.800 10.460 -4.886 1.00 0.00 H new ATOM 0 HG2 LYS B 850 13.774 10.107 -7.436 1.00 0.00 H new ATOM 0 HG3 LYS B 850 12.196 10.869 -7.391 1.00 0.00 H new ATOM 0 HD2 LYS B 850 13.175 12.840 -6.235 1.00 0.00 H new ATOM 0 HD3 LYS B 850 14.752 12.076 -6.261 1.00 0.00 H new ATOM 0 HE2 LYS B 850 14.742 12.081 -8.730 1.00 0.00 H new ATOM 0 HE3 LYS B 850 13.133 12.775 -8.740 1.00 0.00 H new ATOM 0 HZ1 LYS B 850 14.813 14.455 -9.054 1.00 0.00 H new ATOM 0 HZ2 LYS B 850 13.993 14.718 -7.591 1.00 0.00 H new ATOM 0 HZ3 LYS B 850 15.552 14.046 -7.581 1.00 0.00 H new ATOM 1767 N ASN B 851 11.177 8.702 -3.708 1.00 0.00 N ATOM 1768 CA ASN B 851 10.667 8.389 -2.404 1.00 0.00 C ATOM 1769 C ASN B 851 10.413 6.919 -2.200 1.00 0.00 C ATOM 1770 O ASN B 851 10.680 6.411 -1.145 1.00 0.00 O ATOM 1771 CB ASN B 851 9.422 9.188 -2.115 1.00 0.00 C ATOM 1772 CG ASN B 851 9.730 10.633 -1.842 1.00 0.00 C ATOM 1773 OD1 ASN B 851 10.793 10.966 -1.329 1.00 0.00 O ATOM 1774 ND2 ASN B 851 8.835 11.500 -2.181 1.00 0.00 N ATOM 0 H ASN B 851 10.537 9.255 -4.278 1.00 0.00 H new ATOM 0 HA ASN B 851 11.447 8.667 -1.695 1.00 0.00 H new ATOM 0 HB2 ASN B 851 8.741 9.117 -2.963 1.00 0.00 H new ATOM 0 HB3 ASN B 851 8.907 8.759 -1.256 1.00 0.00 H new ATOM 0 HD21 ASN B 851 9.002 12.494 -2.024 1.00 0.00 H new ATOM 0 HD22 ASN B 851 7.961 11.191 -2.606 1.00 0.00 H new ATOM 1781 N CYS B 852 9.924 6.240 -3.219 1.00 0.00 N ATOM 1782 CA CYS B 852 9.622 4.824 -3.126 1.00 0.00 C ATOM 1783 C CYS B 852 10.882 4.040 -2.861 1.00 0.00 C ATOM 1784 O CYS B 852 10.899 3.154 -2.019 1.00 0.00 O ATOM 1785 CB CYS B 852 8.932 4.322 -4.393 1.00 0.00 C ATOM 1786 SG CYS B 852 8.403 2.602 -4.296 1.00 0.00 S ATOM 0 H CYS B 852 9.725 6.651 -4.131 1.00 0.00 H new ATOM 0 HA CYS B 852 8.935 4.676 -2.293 1.00 0.00 H new ATOM 0 HB2 CYS B 852 8.064 4.949 -4.596 1.00 0.00 H new ATOM 0 HB3 CYS B 852 9.613 4.437 -5.237 1.00 0.00 H new ATOM 0 HG CYS B 852 8.870 2.065 -3.208 1.00 0.00 H new ATOM 1792 N ARG B 853 11.945 4.422 -3.548 1.00 0.00 N ATOM 1793 CA ARG B 853 13.249 3.829 -3.382 1.00 0.00 C ATOM 1794 C ARG B 853 13.703 4.026 -1.950 1.00 0.00 C ATOM 1795 O ARG B 853 14.093 3.106 -1.264 1.00 0.00 O ATOM 1796 CB ARG B 853 14.215 4.526 -4.343 1.00 0.00 C ATOM 1797 CG ARG B 853 15.536 3.822 -4.508 1.00 0.00 C ATOM 1798 CD ARG B 853 16.488 3.983 -3.348 1.00 0.00 C ATOM 1799 NE ARG B 853 17.021 5.349 -3.255 1.00 0.00 N ATOM 1800 CZ ARG B 853 17.402 5.978 -2.128 1.00 0.00 C ATOM 1801 NH1 ARG B 853 17.340 5.366 -0.949 1.00 0.00 N ATOM 1802 NH2 ARG B 853 17.852 7.217 -2.189 1.00 0.00 N ATOM 0 H ARG B 853 11.920 5.165 -4.246 1.00 0.00 H new ATOM 0 HA ARG B 853 13.221 2.761 -3.599 1.00 0.00 H new ATOM 0 HB2 ARG B 853 13.738 4.614 -5.319 1.00 0.00 H new ATOM 0 HB3 ARG B 853 14.398 5.539 -3.985 1.00 0.00 H new ATOM 0 HG2 ARG B 853 15.349 2.759 -4.661 1.00 0.00 H new ATOM 0 HG3 ARG B 853 16.020 4.194 -5.411 1.00 0.00 H new ATOM 0 HD2 ARG B 853 15.974 3.731 -2.420 1.00 0.00 H new ATOM 0 HD3 ARG B 853 17.313 3.279 -3.457 1.00 0.00 H new ATOM 0 HE ARG B 853 17.111 5.870 -4.127 1.00 0.00 H new ATOM 0 HH11 ARG B 853 17.000 4.406 -0.890 1.00 0.00 H new ATOM 0 HH12 ARG B 853 17.633 5.856 -0.104 1.00 0.00 H new ATOM 0 HH21 ARG B 853 17.910 7.695 -3.088 1.00 0.00 H new ATOM 0 HH22 ARG B 853 18.142 7.697 -1.337 1.00 0.00 H new ATOM 1816 N SER B 854 13.597 5.209 -1.512 1.00 0.00 N ATOM 1817 CA SER B 854 14.037 5.584 -0.225 1.00 0.00 C ATOM 1818 C SER B 854 13.191 4.883 0.866 1.00 0.00 C ATOM 1819 O SER B 854 13.702 4.504 1.933 1.00 0.00 O ATOM 1820 CB SER B 854 13.935 7.076 -0.164 1.00 0.00 C ATOM 1821 OG SER B 854 14.712 7.680 -1.201 1.00 0.00 O ATOM 0 H SER B 854 13.190 5.974 -2.050 1.00 0.00 H new ATOM 0 HA SER B 854 15.066 5.275 -0.040 1.00 0.00 H new ATOM 0 HB2 SER B 854 12.892 7.378 -0.262 1.00 0.00 H new ATOM 0 HB3 SER B 854 14.280 7.429 0.808 1.00 0.00 H new ATOM 0 HG SER B 854 14.196 7.688 -2.034 1.00 0.00 H new ATOM 1827 N LEU B 855 11.927 4.624 0.542 1.00 0.00 N ATOM 1828 CA LEU B 855 11.048 3.973 1.452 1.00 0.00 C ATOM 1829 C LEU B 855 11.387 2.541 1.535 1.00 0.00 C ATOM 1830 O LEU B 855 11.722 2.092 2.584 1.00 0.00 O ATOM 1831 CB LEU B 855 9.568 4.136 1.097 1.00 0.00 C ATOM 1832 CG LEU B 855 8.936 5.511 1.326 1.00 0.00 C ATOM 1833 CD1 LEU B 855 7.446 5.421 1.261 1.00 0.00 C ATOM 1834 CD2 LEU B 855 9.371 6.113 2.630 1.00 0.00 C ATOM 0 H LEU B 855 11.506 4.865 -0.355 1.00 0.00 H new ATOM 0 HA LEU B 855 11.189 4.456 2.419 1.00 0.00 H new ATOM 0 HB2 LEU B 855 9.444 3.879 0.045 1.00 0.00 H new ATOM 0 HB3 LEU B 855 9.001 3.405 1.673 1.00 0.00 H new ATOM 0 HG LEU B 855 9.283 6.168 0.529 1.00 0.00 H new ATOM 0 HD11 LEU B 855 7.014 6.408 1.426 1.00 0.00 H new ATOM 0 HD12 LEU B 855 7.146 5.053 0.280 1.00 0.00 H new ATOM 0 HD13 LEU B 855 7.089 4.736 2.030 1.00 0.00 H new ATOM 0 HD21 LEU B 855 8.901 7.088 2.755 1.00 0.00 H new ATOM 0 HD22 LEU B 855 9.074 5.459 3.450 1.00 0.00 H new ATOM 0 HD23 LEU B 855 10.455 6.230 2.633 1.00 0.00 H new ATOM 1846 N MET B 856 11.412 1.855 0.386 1.00 0.00 N ATOM 1847 CA MET B 856 11.713 0.420 0.310 1.00 0.00 C ATOM 1848 C MET B 856 13.012 0.061 1.036 1.00 0.00 C ATOM 1849 O MET B 856 13.190 -1.054 1.494 1.00 0.00 O ATOM 1850 CB MET B 856 11.719 -0.110 -1.149 1.00 0.00 C ATOM 1851 CG MET B 856 12.703 0.563 -2.083 1.00 0.00 C ATOM 1852 SD MET B 856 12.762 -0.159 -3.742 1.00 0.00 S ATOM 1853 CE MET B 856 11.100 0.132 -4.316 1.00 0.00 C ATOM 0 H MET B 856 11.223 2.281 -0.521 1.00 0.00 H new ATOM 0 HA MET B 856 10.899 -0.085 0.830 1.00 0.00 H new ATOM 0 HB2 MET B 856 11.937 -1.178 -1.128 1.00 0.00 H new ATOM 0 HB3 MET B 856 10.717 0.003 -1.562 1.00 0.00 H new ATOM 0 HG2 MET B 856 12.444 1.618 -2.167 1.00 0.00 H new ATOM 0 HG3 MET B 856 13.698 0.513 -1.641 1.00 0.00 H new ATOM 0 HE1 MET B 856 11.128 0.496 -5.343 1.00 0.00 H new ATOM 0 HE2 MET B 856 10.533 -0.798 -4.276 1.00 0.00 H new ATOM 0 HE3 MET B 856 10.621 0.876 -3.680 1.00 0.00 H new ATOM 1863 N HIS B 857 13.920 1.016 1.089 1.00 0.00 N ATOM 1864 CA HIS B 857 15.191 0.840 1.749 1.00 0.00 C ATOM 1865 C HIS B 857 15.137 1.033 3.265 1.00 0.00 C ATOM 1866 O HIS B 857 15.878 0.373 3.995 1.00 0.00 O ATOM 1867 CB HIS B 857 16.262 1.699 1.093 1.00 0.00 C ATOM 1868 CG HIS B 857 16.743 1.108 -0.194 1.00 0.00 C ATOM 1869 ND1 HIS B 857 16.248 1.228 -1.436 1.00 0.00 N flip ATOM 1870 CD2 HIS B 857 17.816 0.260 -0.304 1.00 0.00 C flip ATOM 1871 CE1 HIS B 857 16.986 0.478 -2.309 1.00 0.00 C flip ATOM 1872 NE2 HIS B 857 17.919 -0.089 -1.588 1.00 0.00 N flip ATOM 0 H HIS B 857 13.793 1.938 0.673 1.00 0.00 H new ATOM 0 HA HIS B 857 15.464 -0.207 1.617 1.00 0.00 H new ATOM 0 HB2 HIS B 857 15.864 2.696 0.907 1.00 0.00 H new ATOM 0 HB3 HIS B 857 17.104 1.814 1.776 1.00 0.00 H new ATOM 0 HD1 HIS B 857 15.440 1.796 -1.691 1.00 0.00 H new ATOM 0 HD2 HIS B 857 18.459 -0.065 0.500 1.00 0.00 H new ATOM 0 HE1 HIS B 857 16.831 0.375 -3.373 1.00 0.00 H new ATOM 1880 N HIS B 858 14.294 1.924 3.739 1.00 0.00 N ATOM 1881 CA HIS B 858 14.170 2.148 5.190 1.00 0.00 C ATOM 1882 C HIS B 858 13.073 1.294 5.837 1.00 0.00 C ATOM 1883 O HIS B 858 13.234 0.786 6.958 1.00 0.00 O ATOM 1884 CB HIS B 858 13.939 3.626 5.514 1.00 0.00 C ATOM 1885 CG HIS B 858 15.177 4.482 5.479 1.00 0.00 C ATOM 1886 ND1 HIS B 858 15.745 5.049 6.606 1.00 0.00 N ATOM 1887 CD2 HIS B 858 15.939 4.893 4.433 1.00 0.00 C ATOM 1888 CE1 HIS B 858 16.802 5.770 6.222 1.00 0.00 C ATOM 1889 NE2 HIS B 858 16.969 5.708 4.907 1.00 0.00 N ATOM 0 H HIS B 858 13.686 2.505 3.163 1.00 0.00 H new ATOM 0 HA HIS B 858 15.123 1.835 5.618 1.00 0.00 H new ATOM 0 HB2 HIS B 858 13.215 4.030 4.806 1.00 0.00 H new ATOM 0 HB3 HIS B 858 13.491 3.700 6.505 1.00 0.00 H new ATOM 0 HD2 HIS B 858 15.774 4.631 3.398 1.00 0.00 H new ATOM 0 HE1 HIS B 858 17.437 6.329 6.893 1.00 0.00 H new ATOM 0 HE2 HIS B 858 17.698 6.162 4.357 1.00 0.00 H new ATOM 1897 N VAL B 859 11.982 1.142 5.153 1.00 0.00 N ATOM 1898 CA VAL B 859 10.851 0.408 5.665 1.00 0.00 C ATOM 1899 C VAL B 859 10.907 -1.041 5.158 1.00 0.00 C ATOM 1900 O VAL B 859 11.338 -1.285 4.035 1.00 0.00 O ATOM 1901 CB VAL B 859 9.497 1.110 5.266 1.00 0.00 C ATOM 1902 CG1 VAL B 859 9.233 1.099 3.787 1.00 0.00 C ATOM 1903 CG2 VAL B 859 8.337 0.540 5.994 1.00 0.00 C ATOM 0 H VAL B 859 11.843 1.523 4.217 1.00 0.00 H new ATOM 0 HA VAL B 859 10.895 0.395 6.754 1.00 0.00 H new ATOM 0 HB VAL B 859 9.620 2.151 5.565 1.00 0.00 H new ATOM 0 HG11 VAL B 859 8.286 1.598 3.583 1.00 0.00 H new ATOM 0 HG12 VAL B 859 10.038 1.622 3.270 1.00 0.00 H new ATOM 0 HG13 VAL B 859 9.184 0.069 3.434 1.00 0.00 H new ATOM 0 HG21 VAL B 859 7.426 1.054 5.687 1.00 0.00 H new ATOM 0 HG22 VAL B 859 8.249 -0.522 5.764 1.00 0.00 H new ATOM 0 HG23 VAL B 859 8.482 0.668 7.067 1.00 0.00 H new ATOM 1913 N LYS B 860 10.494 -1.999 5.990 1.00 0.00 N ATOM 1914 CA LYS B 860 10.526 -3.389 5.611 1.00 0.00 C ATOM 1915 C LYS B 860 9.523 -3.648 4.512 1.00 0.00 C ATOM 1916 O LYS B 860 9.832 -4.296 3.497 1.00 0.00 O ATOM 1917 CB LYS B 860 10.185 -4.270 6.801 1.00 0.00 C ATOM 1918 CG LYS B 860 10.159 -5.718 6.442 1.00 0.00 C ATOM 1919 CD LYS B 860 8.985 -6.399 7.057 1.00 0.00 C ATOM 1920 CE LYS B 860 8.784 -7.727 6.397 1.00 0.00 C ATOM 1921 NZ LYS B 860 7.593 -8.455 6.911 1.00 0.00 N ATOM 0 H LYS B 860 10.135 -1.825 6.929 1.00 0.00 H new ATOM 0 HA LYS B 860 11.531 -3.624 5.260 1.00 0.00 H new ATOM 0 HB2 LYS B 860 10.916 -4.107 7.593 1.00 0.00 H new ATOM 0 HB3 LYS B 860 9.213 -3.979 7.200 1.00 0.00 H new ATOM 0 HG2 LYS B 860 10.121 -5.827 5.358 1.00 0.00 H new ATOM 0 HG3 LYS B 860 11.079 -6.196 6.778 1.00 0.00 H new ATOM 0 HD2 LYS B 860 9.146 -6.532 8.127 1.00 0.00 H new ATOM 0 HD3 LYS B 860 8.092 -5.784 6.943 1.00 0.00 H new ATOM 0 HE2 LYS B 860 8.678 -7.580 5.322 1.00 0.00 H new ATOM 0 HE3 LYS B 860 9.672 -8.341 6.549 1.00 0.00 H new ATOM 0 HZ1 LYS B 860 7.889 -9.371 7.304 1.00 0.00 H new ATOM 0 HZ2 LYS B 860 7.136 -7.891 7.655 1.00 0.00 H new ATOM 0 HZ3 LYS B 860 6.920 -8.613 6.134 1.00 0.00 H new ATOM 1935 N ASN B 861 8.318 -3.141 4.704 1.00 0.00 N ATOM 1936 CA ASN B 861 7.264 -3.377 3.743 1.00 0.00 C ATOM 1937 C ASN B 861 6.167 -2.366 3.882 1.00 0.00 C ATOM 1938 O ASN B 861 6.155 -1.577 4.824 1.00 0.00 O ATOM 1939 CB ASN B 861 6.675 -4.810 3.827 1.00 0.00 C ATOM 1940 CG ASN B 861 5.882 -5.138 5.094 1.00 0.00 C ATOM 1941 OD1 ASN B 861 6.274 -4.625 6.234 1.00 0.00 O flip ATOM 1942 ND2 ASN B 861 4.940 -5.880 5.039 1.00 0.00 N flip ATOM 0 H ASN B 861 8.050 -2.571 5.506 1.00 0.00 H new ATOM 0 HA ASN B 861 7.727 -3.274 2.762 1.00 0.00 H new ATOM 0 HB2 ASN B 861 6.025 -4.965 2.966 1.00 0.00 H new ATOM 0 HB3 ASN B 861 7.494 -5.524 3.741 1.00 0.00 H new ATOM 0 HD21 ASN B 861 4.649 -6.270 4.142 1.00 0.00 H new ATOM 0 HD22 ASN B 861 4.430 -6.121 5.889 1.00 0.00 H new ATOM 1949 N ILE B 862 5.249 -2.415 2.948 1.00 0.00 N ATOM 1950 CA ILE B 862 4.076 -1.552 2.893 1.00 0.00 C ATOM 1951 C ILE B 862 3.247 -1.593 4.206 1.00 0.00 C ATOM 1952 O ILE B 862 2.654 -0.600 4.609 1.00 0.00 O ATOM 1953 CB ILE B 862 3.165 -1.859 1.630 1.00 0.00 C ATOM 1954 CG1 ILE B 862 3.283 -3.302 1.160 1.00 0.00 C ATOM 1955 CG2 ILE B 862 3.451 -0.945 0.465 1.00 0.00 C ATOM 1956 CD1 ILE B 862 2.915 -4.309 2.176 1.00 0.00 C ATOM 0 H ILE B 862 5.292 -3.078 2.174 1.00 0.00 H new ATOM 0 HA ILE B 862 4.455 -0.536 2.784 1.00 0.00 H new ATOM 0 HB ILE B 862 2.147 -1.679 1.976 1.00 0.00 H new ATOM 0 HG12 ILE B 862 2.648 -3.439 0.285 1.00 0.00 H new ATOM 0 HG13 ILE B 862 4.309 -3.484 0.841 1.00 0.00 H new ATOM 0 HG21 ILE B 862 2.798 -1.203 -0.369 1.00 0.00 H new ATOM 0 HG22 ILE B 862 3.271 0.089 0.761 1.00 0.00 H new ATOM 0 HG23 ILE B 862 4.491 -1.059 0.160 1.00 0.00 H new ATOM 0 HD11 ILE B 862 3.028 -5.308 1.756 1.00 0.00 H new ATOM 0 HD12 ILE B 862 3.566 -4.204 3.044 1.00 0.00 H new ATOM 0 HD13 ILE B 862 1.879 -4.158 2.479 1.00 0.00 H new ATOM 1968 N ALA B 863 3.279 -2.724 4.893 1.00 0.00 N ATOM 1969 CA ALA B 863 2.567 -2.881 6.135 1.00 0.00 C ATOM 1970 C ALA B 863 3.152 -1.965 7.193 1.00 0.00 C ATOM 1971 O ALA B 863 2.441 -1.318 7.963 1.00 0.00 O ATOM 1972 CB ALA B 863 2.600 -4.338 6.584 1.00 0.00 C ATOM 0 H ALA B 863 3.799 -3.551 4.600 1.00 0.00 H new ATOM 0 HA ALA B 863 1.524 -2.601 5.985 1.00 0.00 H new ATOM 0 HB1 ALA B 863 2.058 -4.441 7.524 1.00 0.00 H new ATOM 0 HB2 ALA B 863 2.131 -4.964 5.824 1.00 0.00 H new ATOM 0 HB3 ALA B 863 3.634 -4.652 6.725 1.00 0.00 H new ATOM 1978 N GLU B 864 4.445 -1.815 7.128 1.00 0.00 N ATOM 1979 CA GLU B 864 5.155 -1.044 8.085 1.00 0.00 C ATOM 1980 C GLU B 864 4.930 0.432 7.892 1.00 0.00 C ATOM 1981 O GLU B 864 4.804 1.153 8.855 1.00 0.00 O ATOM 1982 CB GLU B 864 6.616 -1.329 8.046 1.00 0.00 C ATOM 1983 CG GLU B 864 7.102 -2.465 8.902 1.00 0.00 C ATOM 1984 CD GLU B 864 8.555 -2.302 9.255 1.00 0.00 C ATOM 1985 OE1 GLU B 864 9.329 -1.812 8.416 1.00 0.00 O ATOM 1986 OE2 GLU B 864 8.929 -2.599 10.406 1.00 0.00 O ATOM 0 H GLU B 864 5.030 -2.230 6.403 1.00 0.00 H new ATOM 0 HA GLU B 864 4.765 -1.333 9.061 1.00 0.00 H new ATOM 0 HB2 GLU B 864 6.895 -1.537 7.013 1.00 0.00 H new ATOM 0 HB3 GLU B 864 7.148 -0.426 8.344 1.00 0.00 H new ATOM 0 HG2 GLU B 864 6.508 -2.516 9.814 1.00 0.00 H new ATOM 0 HG3 GLU B 864 6.957 -3.408 8.375 1.00 0.00 H new ATOM 1993 N LEU B 865 4.852 0.874 6.643 1.00 0.00 N ATOM 1994 CA LEU B 865 4.618 2.283 6.362 1.00 0.00 C ATOM 1995 C LEU B 865 3.225 2.691 6.807 1.00 0.00 C ATOM 1996 O LEU B 865 2.973 3.823 7.171 1.00 0.00 O ATOM 1997 CB LEU B 865 4.957 2.665 4.900 1.00 0.00 C ATOM 1998 CG LEU B 865 4.284 1.886 3.776 1.00 0.00 C ATOM 1999 CD1 LEU B 865 2.837 2.293 3.568 1.00 0.00 C ATOM 2000 CD2 LEU B 865 5.073 2.006 2.503 1.00 0.00 C ATOM 0 H LEU B 865 4.946 0.283 5.817 1.00 0.00 H new ATOM 0 HA LEU B 865 5.317 2.871 6.957 1.00 0.00 H new ATOM 0 HB2 LEU B 865 4.713 3.719 4.767 1.00 0.00 H new ATOM 0 HB3 LEU B 865 6.035 2.569 4.772 1.00 0.00 H new ATOM 0 HG LEU B 865 4.268 0.839 4.077 1.00 0.00 H new ATOM 0 HD11 LEU B 865 2.407 1.707 2.756 1.00 0.00 H new ATOM 0 HD12 LEU B 865 2.273 2.113 4.483 1.00 0.00 H new ATOM 0 HD13 LEU B 865 2.790 3.352 3.315 1.00 0.00 H new ATOM 0 HD21 LEU B 865 4.576 1.443 1.713 1.00 0.00 H new ATOM 0 HD22 LEU B 865 5.140 3.055 2.214 1.00 0.00 H new ATOM 0 HD23 LEU B 865 6.076 1.607 2.657 1.00 0.00 H new ATOM 2012 N ALA B 866 2.340 1.729 6.783 1.00 0.00 N ATOM 2013 CA ALA B 866 0.964 1.942 7.222 1.00 0.00 C ATOM 2014 C ALA B 866 0.868 1.796 8.744 1.00 0.00 C ATOM 2015 O ALA B 866 -0.133 2.165 9.366 1.00 0.00 O ATOM 2016 CB ALA B 866 0.026 0.962 6.535 1.00 0.00 C ATOM 0 H ALA B 866 2.538 0.781 6.464 1.00 0.00 H new ATOM 0 HA ALA B 866 0.664 2.953 6.947 1.00 0.00 H new ATOM 0 HB1 ALA B 866 -0.995 1.136 6.875 1.00 0.00 H new ATOM 0 HB2 ALA B 866 0.078 1.104 5.456 1.00 0.00 H new ATOM 0 HB3 ALA B 866 0.321 -0.058 6.781 1.00 0.00 H new ATOM 2022 N ALA B 867 1.904 1.243 9.333 1.00 0.00 N ATOM 2023 CA ALA B 867 1.961 1.037 10.764 1.00 0.00 C ATOM 2024 C ALA B 867 2.837 2.084 11.434 1.00 0.00 C ATOM 2025 O ALA B 867 3.113 1.993 12.637 1.00 0.00 O ATOM 2026 CB ALA B 867 2.487 -0.358 11.077 1.00 0.00 C ATOM 0 H ALA B 867 2.733 0.922 8.833 1.00 0.00 H new ATOM 0 HA ALA B 867 0.949 1.134 11.157 1.00 0.00 H new ATOM 0 HB1 ALA B 867 2.524 -0.499 12.157 1.00 0.00 H new ATOM 0 HB2 ALA B 867 1.825 -1.104 10.637 1.00 0.00 H new ATOM 0 HB3 ALA B 867 3.488 -0.471 10.661 1.00 0.00 H new ATOM 2032 N LEU B 868 3.281 3.060 10.681 1.00 0.00 N ATOM 2033 CA LEU B 868 4.119 4.089 11.235 1.00 0.00 C ATOM 2034 C LEU B 868 3.431 5.434 11.291 1.00 0.00 C ATOM 2035 O LEU B 868 2.414 5.655 10.635 1.00 0.00 O ATOM 2036 CB LEU B 868 5.531 4.118 10.601 1.00 0.00 C ATOM 2037 CG LEU B 868 5.645 4.206 9.090 1.00 0.00 C ATOM 2038 CD1 LEU B 868 5.216 5.549 8.575 1.00 0.00 C ATOM 2039 CD2 LEU B 868 7.054 3.875 8.638 1.00 0.00 C ATOM 0 H LEU B 868 3.076 3.162 9.687 1.00 0.00 H new ATOM 0 HA LEU B 868 4.292 3.824 12.278 1.00 0.00 H new ATOM 0 HB2 LEU B 868 6.067 4.968 11.024 1.00 0.00 H new ATOM 0 HB3 LEU B 868 6.057 3.218 10.921 1.00 0.00 H new ATOM 0 HG LEU B 868 4.965 3.466 8.666 1.00 0.00 H new ATOM 0 HD11 LEU B 868 5.313 5.570 7.490 1.00 0.00 H new ATOM 0 HD12 LEU B 868 4.177 5.729 8.850 1.00 0.00 H new ATOM 0 HD13 LEU B 868 5.846 6.324 9.011 1.00 0.00 H new ATOM 0 HD21 LEU B 868 7.113 3.944 7.552 1.00 0.00 H new ATOM 0 HD22 LEU B 868 7.755 4.580 9.085 1.00 0.00 H new ATOM 0 HD23 LEU B 868 7.308 2.863 8.952 1.00 0.00 H new ATOM 2051 N SER B 869 3.987 6.314 12.064 1.00 0.00 N ATOM 2052 CA SER B 869 3.400 7.591 12.339 1.00 0.00 C ATOM 2053 C SER B 869 3.728 8.604 11.226 1.00 0.00 C ATOM 2054 O SER B 869 4.631 8.370 10.401 1.00 0.00 O ATOM 2055 CB SER B 869 3.908 8.043 13.700 1.00 0.00 C ATOM 2056 OG SER B 869 3.726 6.989 14.653 1.00 0.00 O ATOM 0 H SER B 869 4.881 6.163 12.532 1.00 0.00 H new ATOM 0 HA SER B 869 2.313 7.519 12.362 1.00 0.00 H new ATOM 0 HB2 SER B 869 4.963 8.311 13.636 1.00 0.00 H new ATOM 0 HB3 SER B 869 3.371 8.935 14.022 1.00 0.00 H new ATOM 0 HG SER B 869 4.055 7.280 15.529 1.00 0.00 H new ATOM 2062 N GLN B 870 3.029 9.739 11.224 1.00 0.00 N ATOM 2063 CA GLN B 870 3.151 10.723 10.169 1.00 0.00 C ATOM 2064 C GLN B 870 4.551 11.358 10.186 1.00 0.00 C ATOM 2065 O GLN B 870 5.093 11.733 9.164 1.00 0.00 O ATOM 2066 CB GLN B 870 2.029 11.755 10.326 1.00 0.00 C ATOM 2067 CG GLN B 870 1.559 12.458 9.041 1.00 0.00 C ATOM 2068 CD GLN B 870 2.414 13.601 8.552 1.00 0.00 C ATOM 2069 OE1 GLN B 870 3.268 13.331 7.618 1.00 0.00 O flip ATOM 2070 NE2 GLN B 870 2.241 14.736 8.961 1.00 0.00 N flip ATOM 0 H GLN B 870 2.366 9.994 11.956 1.00 0.00 H new ATOM 0 HA GLN B 870 3.042 10.251 9.192 1.00 0.00 H new ATOM 0 HB2 GLN B 870 1.170 11.259 10.777 1.00 0.00 H new ATOM 0 HB3 GLN B 870 2.363 12.518 11.030 1.00 0.00 H new ATOM 0 HG2 GLN B 870 1.497 11.714 8.247 1.00 0.00 H new ATOM 0 HG3 GLN B 870 0.549 12.833 9.206 1.00 0.00 H new ATOM 0 HE21 GLN B 870 1.559 14.914 9.699 1.00 0.00 H new ATOM 0 HE22 GLN B 870 2.778 15.508 8.566 1.00 0.00 H new ATOM 2079 N ASP B 871 5.133 11.443 11.327 1.00 0.00 N ATOM 2080 CA ASP B 871 6.477 11.969 11.428 1.00 0.00 C ATOM 2081 C ASP B 871 7.518 10.990 10.886 1.00 0.00 C ATOM 2082 O ASP B 871 8.503 11.402 10.274 1.00 0.00 O ATOM 2083 CB ASP B 871 6.794 12.428 12.838 1.00 0.00 C ATOM 2084 CG ASP B 871 6.030 13.683 13.212 1.00 0.00 C ATOM 2085 OD1 ASP B 871 6.520 14.800 12.927 1.00 0.00 O ATOM 2086 OD2 ASP B 871 4.912 13.578 13.779 1.00 0.00 O ATOM 0 H ASP B 871 4.714 11.160 12.213 1.00 0.00 H new ATOM 0 HA ASP B 871 6.526 12.852 10.791 1.00 0.00 H new ATOM 0 HB2 ASP B 871 6.550 11.632 13.542 1.00 0.00 H new ATOM 0 HB3 ASP B 871 7.864 12.615 12.926 1.00 0.00 H new ATOM 2091 N GLU B 872 7.253 9.690 11.051 1.00 0.00 N ATOM 2092 CA GLU B 872 8.175 8.636 10.592 1.00 0.00 C ATOM 2093 C GLU B 872 8.352 8.683 9.085 1.00 0.00 C ATOM 2094 O GLU B 872 9.464 8.837 8.587 1.00 0.00 O ATOM 2095 CB GLU B 872 7.614 7.263 10.952 1.00 0.00 C ATOM 2096 CG GLU B 872 7.551 6.960 12.421 1.00 0.00 C ATOM 2097 CD GLU B 872 8.913 6.849 13.029 1.00 0.00 C ATOM 2098 OE1 GLU B 872 9.532 5.773 12.949 1.00 0.00 O ATOM 2099 OE2 GLU B 872 9.397 7.840 13.592 1.00 0.00 O ATOM 0 H GLU B 872 6.407 9.338 11.499 1.00 0.00 H new ATOM 0 HA GLU B 872 9.135 8.804 11.080 1.00 0.00 H new ATOM 0 HB2 GLU B 872 6.609 7.179 10.537 1.00 0.00 H new ATOM 0 HB3 GLU B 872 8.224 6.501 10.467 1.00 0.00 H new ATOM 0 HG2 GLU B 872 6.990 7.744 12.929 1.00 0.00 H new ATOM 0 HG3 GLU B 872 7.008 6.028 12.576 1.00 0.00 H new ATOM 2106 N LEU B 873 7.250 8.622 8.361 1.00 0.00 N ATOM 2107 CA LEU B 873 7.309 8.715 6.912 1.00 0.00 C ATOM 2108 C LEU B 873 7.799 10.068 6.417 1.00 0.00 C ATOM 2109 O LEU B 873 8.466 10.142 5.398 1.00 0.00 O ATOM 2110 CB LEU B 873 6.012 8.239 6.230 1.00 0.00 C ATOM 2111 CG LEU B 873 4.680 8.519 6.948 1.00 0.00 C ATOM 2112 CD1 LEU B 873 4.409 9.955 6.976 1.00 0.00 C ATOM 2113 CD2 LEU B 873 3.543 7.840 6.252 1.00 0.00 C ATOM 0 H LEU B 873 6.312 8.510 8.746 1.00 0.00 H new ATOM 0 HA LEU B 873 8.077 8.008 6.598 1.00 0.00 H new ATOM 0 HB2 LEU B 873 5.964 8.699 5.243 1.00 0.00 H new ATOM 0 HB3 LEU B 873 6.090 7.163 6.076 1.00 0.00 H new ATOM 0 HG LEU B 873 4.769 8.133 7.964 1.00 0.00 H new ATOM 0 HD11 LEU B 873 3.464 10.137 7.487 1.00 0.00 H new ATOM 0 HD12 LEU B 873 5.212 10.467 7.506 1.00 0.00 H new ATOM 0 HD13 LEU B 873 4.349 10.334 5.956 1.00 0.00 H new ATOM 0 HD21 LEU B 873 2.614 8.054 6.780 1.00 0.00 H new ATOM 0 HD22 LEU B 873 3.472 8.207 5.228 1.00 0.00 H new ATOM 0 HD23 LEU B 873 3.714 6.764 6.241 1.00 0.00 H new ATOM 2125 N THR B 874 7.501 11.119 7.160 1.00 0.00 N ATOM 2126 CA THR B 874 7.999 12.457 6.836 1.00 0.00 C ATOM 2127 C THR B 874 9.526 12.473 6.817 1.00 0.00 C ATOM 2128 O THR B 874 10.143 12.957 5.861 1.00 0.00 O ATOM 2129 CB THR B 874 7.459 13.518 7.837 1.00 0.00 C ATOM 2130 OG1 THR B 874 6.051 13.664 7.665 1.00 0.00 O ATOM 2131 CG2 THR B 874 8.142 14.871 7.678 1.00 0.00 C ATOM 0 H THR B 874 6.916 11.078 7.995 1.00 0.00 H new ATOM 0 HA THR B 874 7.634 12.715 5.842 1.00 0.00 H new ATOM 0 HB THR B 874 7.681 13.161 8.843 1.00 0.00 H new ATOM 0 HG1 THR B 874 5.584 13.006 8.221 1.00 0.00 H new ATOM 0 HG21 THR B 874 7.728 15.575 8.400 1.00 0.00 H new ATOM 0 HG22 THR B 874 9.212 14.761 7.851 1.00 0.00 H new ATOM 0 HG23 THR B 874 7.975 15.247 6.669 1.00 0.00 H new ATOM 2139 N SER B 875 10.104 11.868 7.829 1.00 0.00 N ATOM 2140 CA SER B 875 11.536 11.794 8.005 1.00 0.00 C ATOM 2141 C SER B 875 12.186 10.987 6.876 1.00 0.00 C ATOM 2142 O SER B 875 13.290 11.314 6.407 1.00 0.00 O ATOM 2143 CB SER B 875 11.824 11.143 9.366 1.00 0.00 C ATOM 2144 OG SER B 875 13.205 11.033 9.637 1.00 0.00 O ATOM 0 H SER B 875 9.579 11.403 8.570 1.00 0.00 H new ATOM 0 HA SER B 875 11.960 12.798 7.974 1.00 0.00 H new ATOM 0 HB2 SER B 875 11.349 11.730 10.152 1.00 0.00 H new ATOM 0 HB3 SER B 875 11.373 10.151 9.392 1.00 0.00 H new ATOM 0 HG SER B 875 13.334 10.615 10.514 1.00 0.00 H new ATOM 2150 N ILE B 876 11.501 9.955 6.422 1.00 0.00 N ATOM 2151 CA ILE B 876 12.056 9.093 5.400 1.00 0.00 C ATOM 2152 C ILE B 876 11.888 9.718 3.996 1.00 0.00 C ATOM 2153 O ILE B 876 12.800 9.689 3.177 1.00 0.00 O ATOM 2154 CB ILE B 876 11.416 7.680 5.436 1.00 0.00 C ATOM 2155 CG1 ILE B 876 11.480 7.104 6.859 1.00 0.00 C ATOM 2156 CG2 ILE B 876 12.173 6.760 4.480 1.00 0.00 C ATOM 2157 CD1 ILE B 876 10.695 5.816 7.044 1.00 0.00 C ATOM 0 H ILE B 876 10.568 9.696 6.742 1.00 0.00 H new ATOM 0 HA ILE B 876 13.120 8.988 5.611 1.00 0.00 H new ATOM 0 HB ILE B 876 10.372 7.753 5.131 1.00 0.00 H new ATOM 0 HG12 ILE B 876 12.523 6.922 7.119 1.00 0.00 H new ATOM 0 HG13 ILE B 876 11.103 7.850 7.559 1.00 0.00 H new ATOM 0 HG21 ILE B 876 11.727 5.766 4.502 1.00 0.00 H new ATOM 0 HG22 ILE B 876 12.116 7.161 3.468 1.00 0.00 H new ATOM 0 HG23 ILE B 876 13.217 6.696 4.787 1.00 0.00 H new ATOM 0 HD11 ILE B 876 10.792 5.476 8.075 1.00 0.00 H new ATOM 0 HD12 ILE B 876 9.644 5.995 6.818 1.00 0.00 H new ATOM 0 HD13 ILE B 876 11.086 5.052 6.372 1.00 0.00 H new ATOM 2169 N LEU B 877 10.726 10.290 3.740 1.00 0.00 N ATOM 2170 CA LEU B 877 10.426 10.903 2.435 1.00 0.00 C ATOM 2171 C LEU B 877 11.140 12.221 2.256 1.00 0.00 C ATOM 2172 O LEU B 877 11.542 12.582 1.144 1.00 0.00 O ATOM 2173 CB LEU B 877 8.926 11.116 2.282 1.00 0.00 C ATOM 2174 CG LEU B 877 8.098 9.845 2.278 1.00 0.00 C ATOM 2175 CD1 LEU B 877 6.643 10.165 2.263 1.00 0.00 C ATOM 2176 CD2 LEU B 877 8.417 9.034 1.080 1.00 0.00 C ATOM 0 H LEU B 877 9.963 10.349 4.415 1.00 0.00 H new ATOM 0 HA LEU B 877 10.781 10.216 1.667 1.00 0.00 H new ATOM 0 HB2 LEU B 877 8.580 11.755 3.094 1.00 0.00 H new ATOM 0 HB3 LEU B 877 8.743 11.655 1.352 1.00 0.00 H new ATOM 0 HG LEU B 877 8.337 9.285 3.182 1.00 0.00 H new ATOM 0 HD11 LEU B 877 6.067 9.240 2.260 1.00 0.00 H new ATOM 0 HD12 LEU B 877 6.389 10.748 3.149 1.00 0.00 H new ATOM 0 HD13 LEU B 877 6.407 10.742 1.369 1.00 0.00 H new ATOM 0 HD21 LEU B 877 7.817 8.124 1.087 1.00 0.00 H new ATOM 0 HD22 LEU B 877 8.194 9.609 0.181 1.00 0.00 H new ATOM 0 HD23 LEU B 877 9.475 8.772 1.089 1.00 0.00 H new ATOM 2188 N GLY B 878 11.281 12.945 3.330 1.00 0.00 N ATOM 2189 CA GLY B 878 11.935 14.232 3.272 1.00 0.00 C ATOM 2190 C GLY B 878 10.965 15.330 2.897 1.00 0.00 C ATOM 2191 O GLY B 878 11.362 16.462 2.608 1.00 0.00 O ATOM 0 H GLY B 878 10.954 12.671 4.257 1.00 0.00 H new ATOM 0 HA2 GLY B 878 12.384 14.457 4.239 1.00 0.00 H new ATOM 0 HA3 GLY B 878 12.746 14.197 2.544 1.00 0.00 H new ATOM 2195 N ASN B 879 9.696 14.990 2.857 1.00 0.00 N ATOM 2196 CA ASN B 879 8.671 15.955 2.567 1.00 0.00 C ATOM 2197 C ASN B 879 7.502 15.647 3.434 1.00 0.00 C ATOM 2198 O ASN B 879 6.945 14.541 3.342 1.00 0.00 O ATOM 2199 CB ASN B 879 8.199 15.843 1.126 1.00 0.00 C ATOM 2200 CG ASN B 879 7.456 17.080 0.642 1.00 0.00 C ATOM 2201 OD1 ASN B 879 6.842 17.802 1.425 1.00 0.00 O ATOM 2202 ND2 ASN B 879 7.475 17.315 -0.635 1.00 0.00 N ATOM 0 H ASN B 879 9.352 14.044 3.024 1.00 0.00 H new ATOM 0 HA ASN B 879 9.073 16.954 2.738 1.00 0.00 H new ATOM 0 HB2 ASN B 879 9.060 15.668 0.481 1.00 0.00 H new ATOM 0 HB3 ASN B 879 7.547 14.975 1.030 1.00 0.00 H new ATOM 0 HD21 ASN B 879 6.971 18.117 -1.013 1.00 0.00 H new ATOM 0 HD22 ASN B 879 7.994 16.698 -1.260 1.00 0.00 H new ATOM 2209 N ALA B 880 7.112 16.592 4.252 1.00 0.00 N ATOM 2210 CA ALA B 880 5.963 16.423 5.108 1.00 0.00 C ATOM 2211 C ALA B 880 4.695 16.328 4.281 1.00 0.00 C ATOM 2212 O ALA B 880 3.773 15.649 4.662 1.00 0.00 O ATOM 2213 CB ALA B 880 5.863 17.548 6.128 1.00 0.00 C ATOM 0 H ALA B 880 7.578 17.495 4.344 1.00 0.00 H new ATOM 0 HA ALA B 880 6.087 15.490 5.658 1.00 0.00 H new ATOM 0 HB1 ALA B 880 4.987 17.392 6.758 1.00 0.00 H new ATOM 0 HB2 ALA B 880 6.759 17.557 6.749 1.00 0.00 H new ATOM 0 HB3 ALA B 880 5.771 18.502 5.609 1.00 0.00 H new ATOM 2219 N ALA B 881 4.685 16.977 3.112 1.00 0.00 N ATOM 2220 CA ALA B 881 3.526 16.941 2.228 1.00 0.00 C ATOM 2221 C ALA B 881 3.312 15.540 1.697 1.00 0.00 C ATOM 2222 O ALA B 881 2.257 14.965 1.890 1.00 0.00 O ATOM 2223 CB ALA B 881 3.699 17.904 1.067 1.00 0.00 C ATOM 0 H ALA B 881 5.466 17.531 2.761 1.00 0.00 H new ATOM 0 HA ALA B 881 2.654 17.244 2.807 1.00 0.00 H new ATOM 0 HB1 ALA B 881 2.821 17.858 0.422 1.00 0.00 H new ATOM 0 HB2 ALA B 881 3.816 18.918 1.450 1.00 0.00 H new ATOM 0 HB3 ALA B 881 4.584 17.628 0.494 1.00 0.00 H new ATOM 2229 N ASN B 882 4.353 14.974 1.085 1.00 0.00 N ATOM 2230 CA ASN B 882 4.286 13.619 0.507 1.00 0.00 C ATOM 2231 C ASN B 882 3.885 12.615 1.548 1.00 0.00 C ATOM 2232 O ASN B 882 2.990 11.783 1.329 1.00 0.00 O ATOM 2233 CB ASN B 882 5.628 13.207 -0.105 1.00 0.00 C ATOM 2234 CG ASN B 882 5.944 13.929 -1.397 1.00 0.00 C ATOM 2235 OD1 ASN B 882 5.050 14.264 -2.166 1.00 0.00 O ATOM 2236 ND2 ASN B 882 7.207 14.189 -1.642 1.00 0.00 N ATOM 0 H ASN B 882 5.259 15.430 0.973 1.00 0.00 H new ATOM 0 HA ASN B 882 3.534 13.641 -0.281 1.00 0.00 H new ATOM 0 HB2 ASN B 882 6.423 13.401 0.615 1.00 0.00 H new ATOM 0 HB3 ASN B 882 5.621 12.133 -0.290 1.00 0.00 H new ATOM 0 HD21 ASN B 882 7.470 14.684 -2.494 1.00 0.00 H new ATOM 0 HD22 ASN B 882 7.926 13.896 -0.980 1.00 0.00 H new ATOM 2243 N ALA B 883 4.543 12.718 2.677 1.00 0.00 N ATOM 2244 CA ALA B 883 4.304 11.893 3.831 1.00 0.00 C ATOM 2245 C ALA B 883 2.891 12.012 4.332 1.00 0.00 C ATOM 2246 O ALA B 883 2.239 11.009 4.587 1.00 0.00 O ATOM 2247 CB ALA B 883 5.252 12.306 4.902 1.00 0.00 C ATOM 0 H ALA B 883 5.285 13.403 2.820 1.00 0.00 H new ATOM 0 HA ALA B 883 4.457 10.851 3.550 1.00 0.00 H new ATOM 0 HB1 ALA B 883 5.089 11.693 5.788 1.00 0.00 H new ATOM 0 HB2 ALA B 883 6.276 12.174 4.553 1.00 0.00 H new ATOM 0 HB3 ALA B 883 5.086 13.354 5.150 1.00 0.00 H new ATOM 2253 N LYS B 884 2.417 13.215 4.467 1.00 0.00 N ATOM 2254 CA LYS B 884 1.098 13.445 4.979 1.00 0.00 C ATOM 2255 C LYS B 884 0.060 12.944 4.016 1.00 0.00 C ATOM 2256 O LYS B 884 -0.935 12.418 4.426 1.00 0.00 O ATOM 2257 CB LYS B 884 0.910 14.931 5.366 1.00 0.00 C ATOM 2258 CG LYS B 884 -0.508 15.354 5.735 1.00 0.00 C ATOM 2259 CD LYS B 884 -1.309 15.756 4.501 1.00 0.00 C ATOM 2260 CE LYS B 884 -2.747 16.124 4.844 1.00 0.00 C ATOM 2261 NZ LYS B 884 -2.817 17.215 5.845 1.00 0.00 N ATOM 0 H LYS B 884 2.931 14.062 4.226 1.00 0.00 H new ATOM 0 HA LYS B 884 0.966 12.873 5.897 1.00 0.00 H new ATOM 0 HB2 LYS B 884 1.564 15.151 6.210 1.00 0.00 H new ATOM 0 HB3 LYS B 884 1.246 15.548 4.532 1.00 0.00 H new ATOM 0 HG2 LYS B 884 -1.012 14.534 6.246 1.00 0.00 H new ATOM 0 HG3 LYS B 884 -0.470 16.190 6.434 1.00 0.00 H new ATOM 0 HD2 LYS B 884 -0.825 16.603 4.016 1.00 0.00 H new ATOM 0 HD3 LYS B 884 -1.307 14.934 3.785 1.00 0.00 H new ATOM 0 HE2 LYS B 884 -3.269 16.430 3.937 1.00 0.00 H new ATOM 0 HE3 LYS B 884 -3.264 15.245 5.229 1.00 0.00 H new ATOM 0 HZ1 LYS B 884 -3.801 17.539 5.938 1.00 0.00 H new ATOM 0 HZ2 LYS B 884 -2.480 16.865 6.764 1.00 0.00 H new ATOM 0 HZ3 LYS B 884 -2.219 18.008 5.536 1.00 0.00 H new ATOM 2275 N GLN B 885 0.345 13.052 2.746 1.00 0.00 N ATOM 2276 CA GLN B 885 -0.587 12.626 1.709 1.00 0.00 C ATOM 2277 C GLN B 885 -0.737 11.147 1.765 1.00 0.00 C ATOM 2278 O GLN B 885 -1.830 10.637 1.737 1.00 0.00 O ATOM 2279 CB GLN B 885 -0.110 13.054 0.340 1.00 0.00 C ATOM 2280 CG GLN B 885 -0.167 14.560 0.118 1.00 0.00 C ATOM 2281 CD GLN B 885 0.432 14.998 -1.205 1.00 0.00 C ATOM 2282 OE1 GLN B 885 1.442 14.301 -1.662 1.00 0.00 O flip ATOM 2283 NE2 GLN B 885 0.007 15.984 -1.793 1.00 0.00 N flip ATOM 0 H GLN B 885 1.222 13.434 2.391 1.00 0.00 H new ATOM 0 HA GLN B 885 -1.553 13.100 1.886 1.00 0.00 H new ATOM 0 HB2 GLN B 885 0.916 12.713 0.199 1.00 0.00 H new ATOM 0 HB3 GLN B 885 -0.718 12.560 -0.418 1.00 0.00 H new ATOM 0 HG2 GLN B 885 -1.206 14.887 0.164 1.00 0.00 H new ATOM 0 HG3 GLN B 885 0.361 15.060 0.930 1.00 0.00 H new ATOM 0 HE21 GLN B 885 -0.782 16.505 -1.410 1.00 0.00 H new ATOM 0 HE22 GLN B 885 0.442 16.284 -2.666 1.00 0.00 H new ATOM 2292 N LEU B 886 0.383 10.480 1.857 1.00 0.00 N ATOM 2293 CA LEU B 886 0.456 9.075 2.036 1.00 0.00 C ATOM 2294 C LEU B 886 -0.270 8.638 3.310 1.00 0.00 C ATOM 2295 O LEU B 886 -1.175 7.833 3.245 1.00 0.00 O ATOM 2296 CB LEU B 886 1.927 8.747 2.086 1.00 0.00 C ATOM 2297 CG LEU B 886 2.357 7.426 2.608 1.00 0.00 C ATOM 2298 CD1 LEU B 886 1.919 6.312 1.680 1.00 0.00 C ATOM 2299 CD2 LEU B 886 3.858 7.451 2.786 1.00 0.00 C ATOM 0 H LEU B 886 1.298 10.928 1.806 1.00 0.00 H new ATOM 0 HA LEU B 886 -0.037 8.540 1.224 1.00 0.00 H new ATOM 0 HB2 LEU B 886 2.319 8.843 1.074 1.00 0.00 H new ATOM 0 HB3 LEU B 886 2.414 9.513 2.690 1.00 0.00 H new ATOM 0 HG LEU B 886 1.886 7.231 3.571 1.00 0.00 H new ATOM 0 HD11 LEU B 886 2.245 5.353 2.083 1.00 0.00 H new ATOM 0 HD12 LEU B 886 0.833 6.318 1.592 1.00 0.00 H new ATOM 0 HD13 LEU B 886 2.364 6.462 0.696 1.00 0.00 H new ATOM 0 HD21 LEU B 886 4.195 6.488 3.170 1.00 0.00 H new ATOM 0 HD22 LEU B 886 4.335 7.646 1.826 1.00 0.00 H new ATOM 0 HD23 LEU B 886 4.128 8.237 3.491 1.00 0.00 H new ATOM 2311 N TYR B 887 0.082 9.243 4.430 1.00 0.00 N ATOM 2312 CA TYR B 887 -0.474 8.865 5.733 1.00 0.00 C ATOM 2313 C TYR B 887 -1.985 9.091 5.767 1.00 0.00 C ATOM 2314 O TYR B 887 -2.751 8.231 6.188 1.00 0.00 O ATOM 2315 CB TYR B 887 0.213 9.685 6.834 1.00 0.00 C ATOM 2316 CG TYR B 887 -0.214 9.352 8.249 1.00 0.00 C ATOM 2317 CD1 TYR B 887 0.413 8.341 8.963 1.00 0.00 C ATOM 2318 CD2 TYR B 887 -1.237 10.058 8.870 1.00 0.00 C ATOM 2319 CE1 TYR B 887 0.030 8.043 10.254 1.00 0.00 C ATOM 2320 CE2 TYR B 887 -1.622 9.766 10.157 1.00 0.00 C ATOM 2321 CZ TYR B 887 -0.987 8.758 10.844 1.00 0.00 C ATOM 2322 OH TYR B 887 -1.373 8.467 12.128 1.00 0.00 O ATOM 0 H TYR B 887 0.757 10.007 4.471 1.00 0.00 H new ATOM 0 HA TYR B 887 -0.291 7.804 5.901 1.00 0.00 H new ATOM 0 HB2 TYR B 887 1.290 9.541 6.753 1.00 0.00 H new ATOM 0 HB3 TYR B 887 0.019 10.742 6.652 1.00 0.00 H new ATOM 0 HD1 TYR B 887 1.212 7.780 8.501 1.00 0.00 H new ATOM 0 HD2 TYR B 887 -1.738 10.849 8.333 1.00 0.00 H new ATOM 0 HE1 TYR B 887 0.525 7.253 10.799 1.00 0.00 H new ATOM 0 HE2 TYR B 887 -2.418 10.325 10.626 1.00 0.00 H new ATOM 0 HH TYR B 887 -2.102 9.065 12.394 1.00 0.00 H new ATOM 2332 N ASP B 888 -2.388 10.224 5.265 1.00 0.00 N ATOM 2333 CA ASP B 888 -3.784 10.641 5.260 1.00 0.00 C ATOM 2334 C ASP B 888 -4.594 9.729 4.374 1.00 0.00 C ATOM 2335 O ASP B 888 -5.651 9.313 4.746 1.00 0.00 O ATOM 2336 CB ASP B 888 -3.894 12.106 4.810 1.00 0.00 C ATOM 2337 CG ASP B 888 -5.306 12.628 4.687 1.00 0.00 C ATOM 2338 OD1 ASP B 888 -5.988 12.796 5.728 1.00 0.00 O ATOM 2339 OD2 ASP B 888 -5.724 12.954 3.557 1.00 0.00 O ATOM 0 H ASP B 888 -1.756 10.902 4.839 1.00 0.00 H new ATOM 0 HA ASP B 888 -4.186 10.569 6.270 1.00 0.00 H new ATOM 0 HB2 ASP B 888 -3.351 12.731 5.520 1.00 0.00 H new ATOM 0 HB3 ASP B 888 -3.397 12.213 3.846 1.00 0.00 H new ATOM 2344 N PHE B 889 -3.987 9.330 3.264 1.00 0.00 N ATOM 2345 CA PHE B 889 -4.582 8.453 2.252 1.00 0.00 C ATOM 2346 C PHE B 889 -4.804 7.081 2.840 1.00 0.00 C ATOM 2347 O PHE B 889 -5.821 6.441 2.616 1.00 0.00 O ATOM 2348 CB PHE B 889 -3.598 8.400 1.053 1.00 0.00 C ATOM 2349 CG PHE B 889 -3.721 7.272 0.048 1.00 0.00 C ATOM 2350 CD1 PHE B 889 -3.170 6.023 0.316 1.00 0.00 C ATOM 2351 CD2 PHE B 889 -4.318 7.478 -1.178 1.00 0.00 C ATOM 2352 CE1 PHE B 889 -3.222 5.007 -0.608 1.00 0.00 C ATOM 2353 CE2 PHE B 889 -4.379 6.457 -2.112 1.00 0.00 C ATOM 2354 CZ PHE B 889 -3.829 5.221 -1.825 1.00 0.00 C ATOM 0 H PHE B 889 -3.036 9.615 3.031 1.00 0.00 H new ATOM 0 HA PHE B 889 -5.550 8.827 1.918 1.00 0.00 H new ATOM 0 HB2 PHE B 889 -3.694 9.338 0.507 1.00 0.00 H new ATOM 0 HB3 PHE B 889 -2.587 8.370 1.459 1.00 0.00 H new ATOM 0 HD1 PHE B 889 -2.692 5.848 1.269 1.00 0.00 H new ATOM 0 HD2 PHE B 889 -4.742 8.444 -1.412 1.00 0.00 H new ATOM 0 HE1 PHE B 889 -2.788 4.044 -0.380 1.00 0.00 H new ATOM 0 HE2 PHE B 889 -4.857 6.626 -3.066 1.00 0.00 H new ATOM 0 HZ PHE B 889 -3.876 4.425 -2.554 1.00 0.00 H new ATOM 2364 N ILE B 890 -3.858 6.660 3.604 1.00 0.00 N ATOM 2365 CA ILE B 890 -3.888 5.372 4.191 1.00 0.00 C ATOM 2366 C ILE B 890 -4.920 5.283 5.315 1.00 0.00 C ATOM 2367 O ILE B 890 -5.698 4.327 5.378 1.00 0.00 O ATOM 2368 CB ILE B 890 -2.470 4.976 4.670 1.00 0.00 C ATOM 2369 CG1 ILE B 890 -1.554 4.824 3.452 1.00 0.00 C ATOM 2370 CG2 ILE B 890 -2.491 3.714 5.502 1.00 0.00 C ATOM 2371 CD1 ILE B 890 -0.126 4.495 3.774 1.00 0.00 C ATOM 0 H ILE B 890 -3.032 7.210 3.840 1.00 0.00 H new ATOM 0 HA ILE B 890 -4.203 4.655 3.433 1.00 0.00 H new ATOM 0 HB ILE B 890 -2.084 5.765 5.315 1.00 0.00 H new ATOM 0 HG12 ILE B 890 -1.956 4.041 2.809 1.00 0.00 H new ATOM 0 HG13 ILE B 890 -1.578 5.751 2.879 1.00 0.00 H new ATOM 0 HG21 ILE B 890 -1.477 3.470 5.819 1.00 0.00 H new ATOM 0 HG22 ILE B 890 -3.118 3.868 6.380 1.00 0.00 H new ATOM 0 HG23 ILE B 890 -2.893 2.893 4.908 1.00 0.00 H new ATOM 0 HD11 ILE B 890 0.445 4.407 2.849 1.00 0.00 H new ATOM 0 HD12 ILE B 890 0.300 5.287 4.389 1.00 0.00 H new ATOM 0 HD13 ILE B 890 -0.084 3.551 4.317 1.00 0.00 H new ATOM 2383 N HIS B 891 -4.982 6.303 6.134 1.00 0.00 N ATOM 2384 CA HIS B 891 -5.823 6.262 7.320 1.00 0.00 C ATOM 2385 C HIS B 891 -7.178 6.961 7.123 1.00 0.00 C ATOM 2386 O HIS B 891 -7.877 7.277 8.093 1.00 0.00 O ATOM 2387 CB HIS B 891 -5.064 6.826 8.536 1.00 0.00 C ATOM 2388 CG HIS B 891 -3.799 6.064 8.868 1.00 0.00 C ATOM 2389 ND1 HIS B 891 -3.767 4.898 9.592 1.00 0.00 N ATOM 2390 CD2 HIS B 891 -2.516 6.316 8.534 1.00 0.00 C ATOM 2391 CE1 HIS B 891 -2.504 4.492 9.675 1.00 0.00 C ATOM 2392 NE2 HIS B 891 -1.700 5.317 9.048 1.00 0.00 N ATOM 0 H HIS B 891 -4.464 7.173 6.008 1.00 0.00 H new ATOM 0 HA HIS B 891 -6.057 5.215 7.510 1.00 0.00 H new ATOM 0 HB2 HIS B 891 -4.810 7.868 8.344 1.00 0.00 H new ATOM 0 HB3 HIS B 891 -5.724 6.813 9.403 1.00 0.00 H new ATOM 0 HD1 HIS B 891 -4.574 4.424 9.997 1.00 0.00 H new ATOM 0 HD2 HIS B 891 -2.177 7.163 7.957 1.00 0.00 H new ATOM 0 HE1 HIS B 891 -2.182 3.600 10.191 1.00 0.00 H new ATOM 2400 N THR B 892 -7.566 7.166 5.888 1.00 0.00 N ATOM 2401 CA THR B 892 -8.862 7.743 5.584 1.00 0.00 C ATOM 2402 C THR B 892 -9.709 6.686 4.878 1.00 0.00 C ATOM 2403 O THR B 892 -9.166 5.743 4.267 1.00 0.00 O ATOM 2404 CB THR B 892 -8.740 9.048 4.726 1.00 0.00 C ATOM 2405 OG1 THR B 892 -10.012 9.698 4.571 1.00 0.00 O ATOM 2406 CG2 THR B 892 -8.161 8.763 3.362 1.00 0.00 C ATOM 0 H THR B 892 -7.002 6.942 5.069 1.00 0.00 H new ATOM 0 HA THR B 892 -9.346 8.041 6.514 1.00 0.00 H new ATOM 0 HB THR B 892 -8.065 9.711 5.267 1.00 0.00 H new ATOM 0 HG1 THR B 892 -9.901 10.509 4.033 1.00 0.00 H new ATOM 0 HG21 THR B 892 -8.091 9.691 2.795 1.00 0.00 H new ATOM 0 HG22 THR B 892 -7.167 8.329 3.472 1.00 0.00 H new ATOM 0 HG23 THR B 892 -8.806 8.062 2.832 1.00 0.00 H new ATOM 2414 N SER B 893 -11.008 6.784 4.993 1.00 0.00 N ATOM 2415 CA SER B 893 -11.860 5.823 4.379 1.00 0.00 C ATOM 2416 C SER B 893 -12.474 6.397 3.114 1.00 0.00 C ATOM 2417 O SER B 893 -13.118 7.422 3.135 1.00 0.00 O ATOM 2418 CB SER B 893 -12.950 5.377 5.346 1.00 0.00 C ATOM 2419 OG SER B 893 -12.394 4.997 6.600 1.00 0.00 O ATOM 0 H SER B 893 -11.490 7.521 5.507 1.00 0.00 H new ATOM 0 HA SER B 893 -11.263 4.951 4.112 1.00 0.00 H new ATOM 0 HB2 SER B 893 -13.666 6.186 5.492 1.00 0.00 H new ATOM 0 HB3 SER B 893 -13.500 4.538 4.919 1.00 0.00 H new ATOM 0 HG SER B 893 -13.112 4.716 7.205 1.00 0.00 H new ATOM 2425 N PHE B 894 -12.208 5.771 2.017 1.00 0.00 N ATOM 2426 CA PHE B 894 -12.813 6.149 0.762 1.00 0.00 C ATOM 2427 C PHE B 894 -14.280 5.775 0.729 1.00 0.00 C ATOM 2428 O PHE B 894 -15.101 6.521 0.224 1.00 0.00 O ATOM 2429 CB PHE B 894 -12.067 5.544 -0.418 1.00 0.00 C ATOM 2430 CG PHE B 894 -11.691 4.105 -0.235 1.00 0.00 C ATOM 2431 CD1 PHE B 894 -12.604 3.112 -0.438 1.00 0.00 C ATOM 2432 CD2 PHE B 894 -10.422 3.762 0.161 1.00 0.00 C ATOM 2433 CE1 PHE B 894 -12.268 1.814 -0.240 1.00 0.00 C ATOM 2434 CE2 PHE B 894 -10.075 2.458 0.353 1.00 0.00 C ATOM 2435 CZ PHE B 894 -10.995 1.478 0.156 1.00 0.00 C ATOM 0 H PHE B 894 -11.566 4.981 1.954 1.00 0.00 H new ATOM 0 HA PHE B 894 -12.742 7.233 0.676 1.00 0.00 H new ATOM 0 HB2 PHE B 894 -12.686 5.635 -1.310 1.00 0.00 H new ATOM 0 HB3 PHE B 894 -11.162 6.124 -0.597 1.00 0.00 H new ATOM 0 HD1 PHE B 894 -13.604 3.363 -0.760 1.00 0.00 H new ATOM 0 HD2 PHE B 894 -9.688 4.537 0.323 1.00 0.00 H new ATOM 0 HE1 PHE B 894 -13.004 1.039 -0.394 1.00 0.00 H new ATOM 0 HE2 PHE B 894 -9.071 2.204 0.661 1.00 0.00 H new ATOM 0 HZ PHE B 894 -10.728 0.443 0.309 1.00 0.00 H new